Structure Information
Structure

Compound Identification

SMILES

OC(=O)[C@@H]1CCCN1C(=O)C1=CC2=C(C=CC(OCC3=C(Cl)C=CC=C3Cl)=C2)N1CC1=CC2=C(OCO2)C=C1Cl

InChIKey

InChIKey=HQKWJJXNMWFQPC-DEOSSOPVSA-N

Formula

C29H23Cl3N2O6

Mass

601.86

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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 - N-acyl-alpha amino acids and derivatives

Direct Parent

N-acyl-alpha amino acids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

N-acyl-alpha-amino acid - Proline or derivatives - Indolecarboxylic acid derivative - Indolecarboxamide derivative - N-alkylindole - Indole or derivatives - Indole - Benzodioxole - 2-heteroaryl carboxamide - N-acylpyrrolidine - Pyrrole-2-carboxamide - Pyrrole-2-carboxylic acid or derivatives - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - 1,3-dichlorobenzene - Alkyl aryl ether - Halobenzene - Chlorobenzene - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Substituted pyrrole - Benzenoid - Pyrrolidine - Pyrrole - Tertiary carboxylic acid amide - Heteroaromatic compound - Carboxamide group - Acetal - Oxacycle - Carboxylic acid - Azacycle - Organoheterocyclic compound - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organopnictogen compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom.

External Descriptors

Not available

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