Structure Information
Structure

Compound Identification

SMILES

CC(=O)OC1=C(C(=O)C(Br)C(Br)C2=CC=CC=C2)C2=CC=CC=C2C=C1

InChIKey

InChIKey=IRKDAWAGWDHZAB-UHFFFAOYSA-N

Formula

C21H16Br2O3

Mass

476.164

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Butyrophenones

Intermediate Tree Nodes

Not available

Direct Parent

Butyrophenones

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

Butyrophenone - Naphthalene - Aryl ketone - Aryl alkyl ketone - Alpha-haloketone - Ketone - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Alkyl halide - Alkyl bromide - Organooxygen compound - Organobromide - Organohalogen compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as butyrophenones. These are compounds containing 1-phenylbutan-1-one moiety.

External Descriptors

Not available

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