Structure Information
Structure

Compound Identification

SMILES

[Br-].CCCCCCCCCCCCCCCCN1C(N)=[N+](CC(=O)C2=CC(Cl)=C(Cl)C=C2)C2=CC=CC=C12

InChIKey

InChIKey=UKNJHHYSKKYKGI-UHFFFAOYSA-N

Formula

C31H44BrCl2N3O

Mass

625.52

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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 heteropolycyclic compounds

Substituents

Alkyl-phenylketone - Benzimidazole - Benzoyl - Aryl alkyl ketone - 1,2-dichlorobenzene - Chlorobenzene - Halobenzene - Aminoimidazole - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-substituted imidazole - Heteroaromatic compound - Azole - Imidazole - Azacycle - Organoheterocyclic compound - Organonitrogen compound - Primary amine - Organic salt - Organic nitrogen compound - Organic bromide salt - Amine - Hydrocarbon derivative - Organic oxide - Organochloride - Organohalogen compound - Organic cation - Aromatic heteropolycyclic 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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