Structure Information
Structure

Compound Identification

SMILES

COC(=O)C[C@H]([NH+]1CCN(CC1)C1=CC=C(OC)C=C1)C(=O)NC1=CC=CC=C1Cl

InChIKey

InChIKey=MBHNTGGYJDWJKT-FQEVSTJZSA-O

Formula

C22H27ClN3O4

Mass

432.92

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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-arylpiperazine - Phenylpiperazine - Alpha-amino acid amide - N-piperazineacetamide - Anilide - Methoxyaniline - Aminophenyl ether - Methoxybenzene - N-arylamide - Aniline or substituted anilines - Phenoxy compound - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Phenol ether - Anisole - N-alkylpiperazine - Halobenzene - Chlorobenzene - Fatty acid methyl ester - Fatty acid ester - Alkyl aryl ether - 1,4-diazinane - Fatty amide - Benzenoid - Monocyclic benzene moiety - Fatty acyl - Piperazine - Aryl halide - Aryl chloride - Methyl ester - Quaternary ammonium salt - Carboxamide group - Carboxylic acid ester - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Ether - Organoheterocyclic compound - Azacycle - Monocarboxylic acid or derivatives - Organic oxide - Amine - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organohalogen compound - Organochloride - Organic cation - 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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