Structure Information
Structure

Compound Identification

SMILES

CN1C(CC(=O)NC(CC(O)=O)C(O)=O)=CC(C)=C1C(=O)C1=CC=C(Cl)C=C1

InChIKey

InChIKey=SEISQYMYXCDENP-UHFFFAOYSA-N

Formula

C19H19ClN2O6

Mass

406.82

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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

Aspartic acid and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aspartic acid or derivatives - N-acyl-alpha amino acid or derivatives - N-acyl-alpha-amino acid - Aryl-phenylketone - Aryl ketone - Benzoyl - Chlorobenzene - Halobenzene - Aryl chloride - Benzenoid - Substituted pyrrole - Dicarboxylic acid or derivatives - Aryl halide - N-methylpyrrole - Monocyclic benzene moiety - Heteroaromatic compound - Pyrrole - Carboxamide group - Secondary carboxylic acid amide - Ketone - Azacycle - Carboxylic acid - Organoheterocyclic compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as aspartic acid and derivatives. These are compounds containing an aspartic acid or a derivative thereof resulting from reaction of aspartic acid 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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