Structure Information
Structure

Compound Identification

SMILES

CCOC1=C(OC)C=C(C=NNC(=O)CCNC(=O)C2=CC=CC=C2F)C=C1Br

InChIKey

InChIKey=YSQPKGLENKPPLS-UHFFFAOYSA-N

Formula

C20H21BrFN3O4

Mass

466.307

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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 homomonocyclic compounds

Substituents

Beta amino acid or derivatives - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Benzoic acid or derivatives - Methoxybenzene - Benzoyl - Anisole - Phenol ether - Phenoxy compound - Bromobenzene - Fluorobenzene - Halobenzene - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Aryl halide - Aryl fluoride - Aryl bromide - Vinylogous halide - Carboxamide group - Secondary carboxylic acid amide - Ether - Organic nitrogen compound - Organic oxide - Organohalogen compound - Organobromide - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Aromatic homomonocyclic 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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