Structure Information
Structure

Compound Identification

SMILES

CN1CCN(CC1)C(=O)OC1=CC=C(CC(NC(=O)C2=CC=CC=C2Cl)C(O)=O)C=C1

InChIKey

InChIKey=KKZBAYODMNBMQJ-UHFFFAOYSA-N

Formula

C22H24ClN3O5

Mass

445.9

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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

Phenylalanine and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenylalanine or derivatives - N-acyl-alpha amino acid or derivatives - N-acyl-alpha-amino acid - Hippuric acid - Hippuric acid or derivatives - 3-phenylpropanoic-acid - Amphetamine or derivatives - Halobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - Piperazine-1-carboxylic acid - Benzamide - Benzoic acid or derivatives - Phenoxy compound - Benzoyl - N-alkylpiperazine - N-methylpiperazine - Halobenzene - Chlorobenzene - 1,4-diazinane - Piperazine - Benzenoid - Aryl halide - Aryl chloride - Monocyclic benzene moiety - Vinylogous halide - Carbamic acid ester - Tertiary amine - Tertiary aliphatic amine - Amino acid - Secondary carboxylic acid amide - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid - Monocarboxylic acid or derivatives - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organochloride - Organohalogen compound - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

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