Structure Information
Structure

Compound Identification

SMILES

CC1=CC(Cl)=CC(C)=C1C(=O)NC(CC1CCN(CC1)C(=O)CC1=NC2=C(CCCN2)C=C1)C(O)=O

InChIKey

InChIKey=WYOYAMYAPAAHJL-UHFFFAOYSA-N

Formula

C27H33ClN4O4

Mass

513.04

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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 or derivatives - N-acyl-alpha-amino acid - Hippuric acid - Diazanaphthalene - Alpha-amino acid or derivatives - Naphthyridine - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - N-acyl-piperidine - M-xylene - Xylene - Benzoyl - Halobenzene - Chlorobenzene - Pyridine - Piperidine - Aryl chloride - Aryl halide - Imidolactam - Heteroaromatic compound - Tertiary carboxylic acid amide - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Carboxylic acid derivative - Carboxylic acid - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Organic oxygen compound - Amine - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organochloride - Organohalogen compound - 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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