Structure Information
Structure

Compound Identification

SMILES

CC(C)C1=CC=C(OC(=O)COC2=C(Br)C3=CC=CC=C3C=C2)C=C1

InChIKey

InChIKey=JZCDICABUHEPCM-UHFFFAOYSA-N

Formula

C21H19BrO3

Mass

399.284

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Phenoxyacetic acid derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Phenoxyacetic acid derivatives

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Phenoxyacetate - Phenol ester - Naphthalene - Phenylpropane - Cumene - Phenoxy compound - Phenol ether - Alkyl aryl ether - Aryl bromide - Aryl halide - Carboxylic acid ester - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Organobromide - Organooxygen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenoxyacetic acid derivatives. These are compounds containing an anisole where the methane group is linked to an acetic acid or a derivative.

External Descriptors

Not available

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