Structure Information
Structure

Compound Identification

SMILES

CC1=C(C=CC(=C1)C(=O)NC(CC(N)=O)C1=NC2=C(N1)C=C(Cl)C=C2)C(=O)N1CCCC1

InChIKey

InChIKey=UXYNEQAEJGCHJZ-UHFFFAOYSA-N

Formula

C23H24ClN5O3

Mass

453.93

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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

Direct Parent

Beta amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Beta amino acid or derivatives - Benzoic acid or derivatives - Benzimidazole - Benzamide - Toluamide - M-toluamide - O-toluamide - Benzoyl - N-acylpyrrolidine - Toluene - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Aryl chloride - Fatty amide - Heteroaromatic compound - Azole - Imidazole - Pyrrolidine - Tertiary carboxylic acid amide - Secondary carboxylic acid amide - Carboxamide group - Primary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Carbonyl group - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.

External Descriptors

Not available

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