Structure Information
Structure

Compound Identification

SMILES

Cl.CC(=O)C1=CC(=CC(Br)=C1)C(=O)NC1=CC2=C(CCN3CCCC23)C=C1

InChIKey

InChIKey=HEQDWFNKDSMIEY-UHFFFAOYSA-N

Formula

C21H22BrClN2O2

Mass

449.77

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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 - Tetrahydroisoquinoline - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Acetophenone - Benzamide - Benzoic acid or derivatives - Benzoyl - Aryl alkyl ketone - Bromobenzene - Aralkylamine - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-alkylpyrrolidine - Pyrrolidine - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Amine - Organohalogen compound - Organobromide - Organonitrogen compound - Hydrochloride - 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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