Structure Information
Structure

Compound Identification

SMILES

OC(=O)C(\NC(=O)C1=CC=CC=C1)=C\C1=CC=C(NC2=CC=CC=C2Cl)C=C1

InChIKey

InChIKey=KOKKXFUTTVLTGZ-ZHZULCJRSA-N

Formula

C22H17ClN2O3

Mass

392.84

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Benzamides - Hippuric acids and derivatives

Direct Parent

Hippuric acids

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Hippuric acid - N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Cinnamic acid or derivatives - Cinnamic acid - Alpha-amino acid or derivatives - Aniline or substituted anilines - Benzoyl - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Primary aromatic amine - Amino acid or derivatives - Secondary carboxylic acid amide - Amino acid - Carboxamide group - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic oxygen compound - Amine - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as hippuric acids. These are compounds containing hippuric acid, which consists of a of a benzoyl group linked to the N-terminal of a glycine.

External Descriptors

Not available

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