Structure Information
Structure

Compound Identification

SMILES

IC1=CC=CC=C1C(=O)NCC(=O)NN=CC1=CC=C(OC(=O)C2=CC=CO2)C=C1

InChIKey

InChIKey=UAECTZMNUSHHCX-UHFFFAOYSA-N

Formula

C21H16IN3O5

Mass

517.279

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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

Direct Parent

Hippuric acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - Phenol ester - N-substituted-alpha-amino acid - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Alpha-amino acid or derivatives - Furoic acid ester - Benzoyl - Phenoxy compound - Furoic acid or derivatives - Halobenzene - Iodobenzene - Aryl iodide - Aryl halide - Heteroaromatic compound - Furan - Vinylogous halide - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organonitrogen compound - Organohalogen compound - Organoiodide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as hippuric acids and derivatives. These are compounds containing a hippuric acid or a derivative, with a structure characterized the presence of a benzoyl group linked to the N-terminal of a glycine.

External Descriptors

Not available

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