Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC=C1NC(C)C(=O)NN\C=C1\C=C(Br)C(=O)C(OC)=C1

InChIKey

InChIKey=BMJZDVHZTVDSEN-BENRWUELSA-N

Formula

C18H20BrN3O4

Mass

422.279

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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

Alanine and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Alanine or derivatives - Aminophenyl ether - Methoxyaniline - Phenoxy compound - Anisole - Quinomethane - Phenol ether - Methoxybenzene - Phenylalkylamine - Aniline or substituted anilines - P-quinomethane - Secondary aliphatic/aromatic amine - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - Alpha-haloketone - Cyclic ketone - Carboxylic acid hydrazide - Ketone - Ether - Bromoalkene - Haloalkene - Vinyl halide - Vinyl bromide - Secondary amine - Organobromide - Organohalogen compound - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Aromatic homomonocyclic compound

Description

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