Structure Information
Structure

Compound Identification

SMILES

COC(=O)C[NH+]1[C@H](NC2=C(C=C(Br)C=C2)[C@@H]1C1=CC=CC=C1)C1=CC(=CC=C1)[N+]([O-])=O

InChIKey

InChIKey=DMMHNRQEFOHLAQ-GOTSBHOMSA-O

Formula

C23H21BrN3O4

Mass

483.341

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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

Alpha amino acid esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alpha-amino acid ester - Quinazoline - Nitrobenzene - Nitroaromatic compound - Secondary aliphatic/aromatic amine - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Quaternary ammonium salt - Methyl ester - Carboxylic acid ester - Organic nitro compound - C-nitro compound - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic oxoazanium - Secondary amine - Organic oxygen compound - Organohalogen compound - Organic salt - Amine - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organobromide - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.

External Descriptors

Not available

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