SDF/Mol File of N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide (C19H17BrN2O2)

Structure Data File (SDF/MOL File) Description

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Additional Information for Identifying N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide Molecule

• Chemical structure of N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide

  By visualizing the structure data file (SDF/MOL File) above, the chemical structure image of N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide is available in chemical structure page of N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide, which specifies the molecular geometry, i.e., the spatial arrangement of atoms and the chemical bonds that hold the atoms together.

• Molecular weight of N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide

  The molecular weight of N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide is available in molecular weight page of N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide, 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 N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide

  The chemical formula of N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide is given in chemical formula page of N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide, 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 N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide

  An alternative way of expressing structural information in text format is InChI. The full standard InChI of N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide is:

  InChI=1S/C19H17BrN2O2/c1-11-8-15(4-5-16(11)20)21-18(23)10-13-3-6-17-14(9-13)7-12(2)19(24)22-17/h3-9H,10H2,1-2H3,(H,21,23)(H,22,24)

  It can provide a standard way to encode the molecular information of N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide 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 N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide is:

  InChIKey=UDWFVKFKELNAER-UHFFFAOYSA-N

  The InChIKey may allow easier web searches for N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide, but it needs to be linked to the full InChI to get back to the original structure of the N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide since the full standard InChI cannot be reconstructed from the InChIKey.

• Other names (synonyms) or registry numbers of N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide

  The N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide compound may be named differently depending on the various situations of industrial applications. Other names (synonyms) of N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide including the registry numbers are listed below, if available:

  
  
  None available.

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N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide Identification Summary Frequently Asked Questions (FAQs)

What’s the N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide formula?
C19H17BrN2O2
How many atoms and what elements are included in the N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide molecule?
41 atom(s) - 17 Hydrogen atom(s), 19 Carbon atom(s), 2 Nitrogen atom(s), 2 Oxygen atom(s), and 1 Bromine atom(s)
How many chemical bonds and what kind of bonds are in the N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide structure?
43 bond(s) - 26 non-H bond(s), 15 multiple bond(s), 3 rotatable bond(s), 3 double bond(s), 12 aromatic bond(s), 3 six-membered ring(s), 1 ten-membered ring(s), and 2 secondary amide(s) (aliphatic)
What’s the N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide’s molar mass?
385.25448 g/mol
What’s the SMILES structure of N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide?
Cc3cc(NC(=O)Cc2ccc1[nH]c(=O)c(C)cc1c2)ccc3Br
What’s the InChI code of N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide?
InChI=1S/C19H17BrN2O2/c1-11-8-15(4-5-16(11)20)21-18(23)10-13-3-6-17-14(9-13)7-12(2)19(24)22-17/h3-9H,10H2,1-2H3,(H,21,23)(H,22,24)
What’s the InChIKey format of N-(4-bromo-3-methylphenyl)-2-(3-methyl-2-oxo-1,2-dihydroquinolin-6-yl)acetamide?
UDWFVKFKELNAER-UHFFFAOYSA-N

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commercialized into Mol-Instincts database and ChemRTP, ChemEssen, Inc (2024).