Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(C=C1)S(O)(=O)=O.C[N+]1(C)CCC(O)(CC1)C(=O)C1=CC=CC=C1

InChIKey

InChIKey=FRUAQZDSIXWICD-UHFFFAOYSA-N

Formula

C21H28NO5S

Mass

406.52

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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

Not available

Substituents

Alkyl-phenylketone - Benzoyl - Aryl alkyl ketone - Monocyclic benzene moiety - Gamma-aminoketone - Piperidine - Benzenoid - Alpha-hydroxy ketone - Tetraalkylammonium salt - Quaternary ammonium salt - Tertiary alcohol - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Alcohol - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Amine - Organic salt - Organic cation - Aromatic heteromonocyclic 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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