SDF/Mol File of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide (C22H28N2O4)

Structure Data File (SDF/MOL File) Description

---

Search Another SDF·MOL File

Enter another compound to search for SDF·MOL file:

Deep Data Application Examples

Our Deep Data encompasses property data, spectral data, quantum chemical data, and molecular descriptor data for a wide range of chemical compounds. It features more than 2,100 high-quality datasets per single chemical compound, totaling over 8 billion datasets for 4.1+ million chemical compounds. Below are some application examples that may interest you:

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

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

  By visualizing the structure data file (SDF/MOL File) above, the chemical structure image of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide is available in chemical structure page of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide, which specifies the molecular geometry, i.e., the spatial arrangement of atoms and the chemical bonds that hold the atoms together.

• Molecular weight of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide

  The molecular weight of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide is available in molecular weight page of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide, which is calculated as the sum of the atomic masses of each constituent element multiplied by the number of atoms of that element.

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

  The chemical formula of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide is given in chemical formula page of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide, which identifies each constituent element by its chemical symbol and indicates the proportionate number of atoms of each element.

• InChI (IUPAC International Chemical Identifier) information of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide

  An alternative way of expressing structural information in text format is InChI. The full standard InChI of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide is:

  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

  It can provide a standard way to encode the molecular information of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide to facilitate the search for the compound information in databases and on the web.

  The condensed, 27 character standard InChIKey (hashed version of the full standard InChI) of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide is:

  InChIKey=RIRHVYKMFDQHJO-UHFFFAOYSA-N

  The InChIKey may allow easier web searches for 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide, but it needs to be linked to the full InChI to get back to the original structure of the 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide since the full standard InChI cannot be reconstructed from the InChIKey.

• 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 named differently depending on the various situations of industrial applications. Other names (synonyms) of 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide including the registry numbers are listed below, 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 4-(2-{[2-hydroxy-2-(4-methoxyphenyl)ethyl](methyl)carbamoyl}ethyl)-N,N-dimethylbenzamide formula?
C22H28N2O4
How many atoms and what elements are included in 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 in 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 molar mass?
384.46872 g/mol
What’s the SMILES structure 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 code 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 format 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).