Structure Information
Structure

Compound Identification

SMILES

CNC1=CC=CC=C1C(=O)OCC(=O)C1=CC=C(Br)C=C1

InChIKey

InChIKey=HSQIULHGKGIGAF-UHFFFAOYSA-N

Formula

C16H14BrNO3

Mass

348.196

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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 - Aminobenzoic acid or derivatives - Benzoate ester - Benzoic acid or derivatives - Phenylalkylamine - Aniline or substituted anilines - Aryl alkyl ketone - Benzoyl - Secondary aliphatic/aromatic amine - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Carboxylic acid ester - Amino acid or derivatives - Carboxylic acid derivative - Secondary amine - Monocarboxylic acid or derivatives - Organohalogen compound - Organobromide - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic nitrogen compound - 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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