Structure Information
Structure

Compound Identification

SMILES

NC(=O)CC(NC(=O)C1=CC=C(Cl)C=C1)C(=O)OCC(=O)C1=CC=C(Br)C=C1

InChIKey

InChIKey=FKQBTGOGLGWDHY-UHFFFAOYSA-N

Formula

C19H16BrClN2O5

Mass

467.7

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Amino acids, peptides, and analogues

Intermediate Tree Nodes

Amino acids and derivatives - Alpha amino acids and derivatives

Direct Parent

Asparagine and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Asparagine or derivatives - Alpha-amino acid ester - Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Alkyl-phenylketone - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzamide - Phenylketone - Aryl ketone - Benzoyl - Aryl alkyl ketone - Chlorobenzene - Fatty acid ester - Halobenzene - Bromobenzene - Alpha-acyloxy ketone - Benzenoid - Aryl halide - Fatty amide - Monocyclic benzene moiety - Aryl bromide - Aryl chloride - Fatty acyl - Carboxamide group - Ketone - Primary carboxylic acid amide - Secondary carboxylic acid amide - Carboxylic acid ester - Monocarboxylic acid or derivatives - Organic nitrogen compound - Carbonyl group - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as asparagine and derivatives. These are compounds containing asparagine or a derivative thereof resulting from reaction of asparagine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.

External Descriptors

Not available

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