Structure Information
Structure

Compound Identification

SMILES

C[C@H](OC(=O)C1CCN(CC1)C1=[NH+]C=C(C=C1)C(F)(F)F)C(=O)C1=CC=CC=C1

InChIKey

InChIKey=KJVPEJGKDYIWMJ-AWEZNQCLSA-O

Formula

C21H22F3N2O3

Mass

407.413

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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 heteromonocyclic compounds

Substituents

Alkyl-phenylketone - Phenylpropane - Piperidinecarboxylic acid - Benzoyl - Dialkylarylamine - Aryl alkyl ketone - Aminopyridine - Alpha-acyloxy ketone - Monocyclic benzene moiety - Benzenoid - Pyridinium - Pyridine - Piperidine - Heteroaromatic compound - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organohalogen compound - Amine - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Organofluoride - Organonitrogen compound - Organic nitrogen compound - 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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