Structure Information
Structure

Compound Identification

SMILES

CCCCN(CC)C1=CC(C)=NC(N(CC(=O)OCC)C2=C(Br)C=C(C=C2)C(C)C)=C1[N+]([O-])=O

InChIKey

InChIKey=NHJKADFIGMXHHC-UHFFFAOYSA-N

Formula

C25H35BrN4O4

Mass

535.483

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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 heteromonocyclic compounds

Substituents

Alpha-amino acid ester - Alkyldiarylamine - Cumene - Phenylpropane - Nitroaromatic compound - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Halobenzene - Methylpyridine - Bromobenzene - Aminopyridine - Monocyclic benzene moiety - Pyridine - Aryl halide - Aryl bromide - Benzenoid - Imidolactam - Heteroaromatic compound - Carboxylic acid ester - Organic nitro compound - Tertiary amine - C-nitro compound - Organic oxoazanium - Monocarboxylic acid or derivatives - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organobromide - Organic nitrogen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic oxygen compound - Amine - Organic salt - Organic cation - Aromatic heteromonocyclic 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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