Structure Information
Structure

Compound Identification

SMILES

COC1=C2C[C@@H](CCC2=C(Br)C=C1)C(O)=O

InChIKey

InChIKey=SHWPEYMQAQIQFK-SSDOTTSWSA-N

Formula

C12H13BrO3

Mass

285.137

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Naphthalenes

Subclass

Naphthalenecarboxylic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Naphthalenecarboxylic acids

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

2-naphthalenecarboxylic acid - Tetralin - Anisole - Phenol ether - Alkyl aryl ether - Aryl bromide - Aryl halide - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organic oxide - Organic oxygen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organobromide - Organohalogen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as naphthalenecarboxylic acids. These are compounds containing a naphthalene moiety, which bears a carboxylic acid group one or more positions. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.

External Descriptors

Not available

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