Structure Information
Structure

Compound Identification

SMILES

CC1=C(C(=O)NC(CC2=CC3=C(C=C2)N(CCC3)C(=O)C2=C(Cl)C=CC=C2Cl)C(O)=O)C(Cl)=CC=C1

InChIKey

InChIKey=YLWFXTONLGZIIF-UHFFFAOYSA-N

Formula

C27H23Cl3N2O4

Mass

545.84

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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 heteropolycyclic compounds

Substituents

N-acyl-alpha-amino acid - N-acyl-alpha amino acid or derivatives - Hippuric acid - Alpha-amino acid or derivatives - Tetrahydroquinoline - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - O-toluamide - Toluamide - Benzoyl - 1,3-dichlorobenzene - Toluene - Halobenzene - Chlorobenzene - Aryl halide - Aryl chloride - Tertiary carboxylic acid amide - Vinylogous halide - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic 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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