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Structure & Deep Data of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide (C22H28N2O4)

Identification of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide Chemical Compound

2D chemical structure image of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide
Chemical Formula C22H28N2O4
Molecular Weight 384.46872 g/mol
IUPAC Name 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide
SMILES String COc1ccc(cc1)C(O)CN(C)C(=O)CCc2ccc(cc2)C(=O)N(C)C
InChI InChI=1S/C22H28N2O4/c1-23(2)22(27)18-8-5-16(6-9-18)7-14-21(26)24(3)15-20(25)17-10-12-19(28-4)13-11-17/h5-6,8-13,20,25H,7,14-15H2,1-4H3
InChIKey RIRHVYKMFDQHJO-UHFFFAOYSA-N

Chemical Structure Description

A chemical structure of a molecule includes the arrangement of atoms and the chemical bonds that hold the atoms together. The 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide molecule contains a total of 57 bond(s). There are 29 non-H bond(s), 14 multiple bond(s), 8 rotatable bond(s), 2 double bond(s), 12 aromatic bond(s), 2 six-membered ring(s), 1 tertiary amide(s) (aliphatic), 1 tertiary amide(s) (aromatic), 1 hydroxyl group(s), 1 secondary alcohol(s), and 1 ether(s) (aromatic). Images of the chemical structure of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide are given below:

2D chemical structure image of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide
2-dimensional (2D) chemical structure image of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide
3D chemical structure image of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide
3-dimensional (3D) chemical structure image of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide

The 2D chemical structure image of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide is also called skeletal formula, which is the standard notation for organic molecules. The carbon atoms in the chemical structure of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide are implied to be located at the corner(s) and hydrogen atoms attached to carbon atoms are not indicated – each carbon atom is considered to be associated with enough hydrogen atoms to provide the carbon atom with four bonds.

The 3D chemical structure image of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide is based on the ball-and-stick model which displays both the three-dimensional position of the atoms and the bonds between them. The radius of the spheres is therefore smaller than the rod lengths in order to provide a clearer view of the atoms and bonds throughout the chemical structure model of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide. Download structure data file (SDF/MOL) file of this compound.


Interactive 3D Visualization

For a better understanding of the chemical structure, an interactive 3D visualization of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide is provided here.

The 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide molecule shown in the visualization screen can be rotated interactively by keep clicking and moving the mouse button. Mouse wheel zoom is available as well – the size of the 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide molecule can be increased or decreased by scrolling the mouse wheel.

The information of the atoms, bonds, connectivity and coordinates included in the chemical structure of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide can easily be identified by this visualization. By right-clicking the visualization screen, various other options are available including the visualization of van der Waals surface and exporting to an image file.


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Additional Information for Identifying 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide Molecule

  • Other names (synonyms) or registry numbers of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide

    The 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide compound may be called differently depending on the various different situations of industrial applications. Below are the list of the other names (synonyms) of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide including the various registry numbers, if available:



    None available.


4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide Identification Summary Frequently Asked Questions (FAQs)

What’s the chemical formula of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide?
C22H28N2O4
How many atoms and what are the elements included the 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide molecule?
56 atom(s) - 28 Hydrogen atom(s), 22 Carbon atom(s), 2 Nitrogen atom(s), and 4 Oxygen atom(s)
How many chemical bonds and what kind of bonds are included the 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide structure?
57 bond(s) - 29 non-H bond(s), 14 multiple bond(s), 8 rotatable bond(s), 2 double bond(s), 12 aromatic bond(s), 2 six-membered ring(s), 1 tertiary amide(s) (aliphatic), 1 tertiary amide(s) (aromatic), 1 hydroxyl group(s), 1 secondary alcohol(s), and 1 ether(s) (aromatic)
What’s the 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide’s molecular weight?
384.46872 g/mol
What’s the SMILES code of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide?
COc1ccc(cc1)C(O)CN(C)C(=O)CCc2ccc(cc2)C(=O)N(C)C
What’s the InChI string of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide?
InChI=1S/C22H28N2O4/c1-23(2)22(27)18-8-5-16(6-9-18)7-14-21(26)24(3)15-20(25)17-10-12-19(28-4)13-11-17/h5-6,8-13,20,25H,7,14-15H2,1-4H3
What’s the InChIKey code of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide?
RIRHVYKMFDQHJO-UHFFFAOYSA-N

33 The contents of this page can freely be shared if cited as follows:
Source: Chemical Compounds Deep Data Source (CCDDS; https://www.molinstincts.com) based on 41 patented QSQN and QN technology
commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2024).

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