Structure Information
Structure

Compound Identification

SMILES

C[C@H](OC(=O)C1=CC=C(Br)C=C1)C(=O)C1=CC=CC=C1

InChIKey

InChIKey=XIRBUDIIOLQKKD-NSHDSACASA-N

Formula

C16H13BrO3

Mass

333.181

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Aryl ketones - Phenylketones

Direct Parent

Alkyl-phenylketones

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Alkyl-phenylketone - Benzoate ester - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Phenylpropane - Benzoic acid or derivatives - Aryl alkyl ketone - Benzoyl - Halobenzene - Bromobenzene - Benzenoid - Aryl halide - Aryl bromide - Monocyclic benzene moiety - Carboxylic acid ester - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxide - Organohalogen compound - Organobromide - Hydrocarbon derivative - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.

External Descriptors

Not available

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