Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@@H]([C@@H]1CCCN1)C1=CC=C(Br)C=C1

InChIKey

InChIKey=OTLAEVCKCVIWLW-NWDGAFQWSA-N

Formula

C13H16BrNO2

Mass

298.18

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Halobenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Bromobenzenes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Bromobenzene - Aralkylamine - Aryl bromide - Aryl halide - Methyl ester - Pyrrolidine - Amino acid or derivatives - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Secondary amine - Carboxylic acid derivative - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Amine - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as bromobenzenes. These are organic compounds containing a bromine atom attached to a benzene ring.

External Descriptors

Not available

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