Structure Information
Structure

Compound Identification

SMILES

CN1N=C(C=C1C1=CC=C(S1)C(=O)N1CCN(CCC(=O)C2=CC=C(C=C2)[N+]([O-])=O)CC1)C(F)(F)F

InChIKey

InChIKey=MURHZOKJFQHFCT-UHFFFAOYSA-N

Formula

C23H22F3N5O4S

Mass

521.52

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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 heteromonocyclic compounds

Substituents

Alkyl-phenylketone - Nitrobenzene - Benzoyl - 2-heteroaryl carboxamide - Thiophene carboxamide - Thiophene carboxylic acid or derivatives - Aryl alkyl ketone - Nitroaromatic compound - N-alkylpiperazine - 2,5-disubstituted thiophene - Monocyclic benzene moiety - Beta-aminoketone - 1,4-diazinane - Piperazine - Benzenoid - Azole - Pyrazole - Tertiary carboxylic acid amide - Thiophene - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Tertiary amine - Tertiary aliphatic amine - Organic nitro compound - C-nitro compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Organic salt - Organic nitrogen compound - Alkyl halide - Organohalogen compound - Organic oxide - Alkyl fluoride - Organofluoride - Organonitrogen compound - Hydrocarbon derivative - Amine - Organic zwitterion - 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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