Structure Information
Structure

Compound Identification

SMILES

OC1=CC(=CC(NC2=NCCCCC2)=C1)C(=O)NCC(=O)N[C@H](CC=O)C1=C(O)C(Cl)=CC(Br)=C1

InChIKey

InChIKey=JUUSNJVJCRVEDX-HXUWFJFHSA-N

Formula

C24H26BrClN4O5

Mass

565.85

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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 - Alpha-amino acid amide - Aminobenzoic acid or derivatives - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - 2-chlorophenol - M-aminophenol - 2-halophenol - 4-halophenol - 4-bromophenol - Benzoyl - Aniline or substituted anilines - Aminophenol - Chlorobenzene - Bromobenzene - 1-hydroxy-4-unsubstituted benzenoid - Azepine - Phenol - Halobenzene - 1-hydroxy-2-unsubstituted benzenoid - Aryl bromide - Aryl chloride - Aryl halide - Imidolactam - Alpha-hydrogen aldehyde - Secondary carboxylic acid amide - Carboxamide group - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Carboxylic acid amidine - Amidine - Organic 1,3-dipolar compound - Azacycle - Organoheterocyclic compound - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Aldehyde - Organic oxide - Hydrocarbon derivative - Amine - Carbonyl group - Organooxygen compound - Organonitrogen compound - Organochloride - Organobromide - 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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