Structure Information
Structure

Compound Identification

SMILES

ClC1=CC=CC(NC=C2C=C(Br)C=CC2=O)=C1

InChIKey

InChIKey=VVSSUYMFVKTQNR-UHFFFAOYSA-N

Formula

C13H9BrClNO

Mass

310.58

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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 - Cyclic ketones - Quinomethanes

Direct Parent

O-quinomethanes

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Aniline or substituted anilines - O-quinomethane - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Vinylogous amide - Allylamine - Enamine - Bromoalkene - Haloalkene - Vinyl bromide - Vinyl halide - Organic oxide - Organic nitrogen compound - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Amine - Hydrocarbon derivative - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as o-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 2, respectively.

External Descriptors

Not available

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