Structure Information
Structure

Compound Identification

SMILES

CSCCC1NC2(C(C1C1=CC=CC=C1)C(=O)C1=CC=CC=C1)C(=O)NC1=C2C=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=OBTFOFHPAILXOY-UHFFFAOYSA-N

Formula

C27H25N3O4S

Mass

487.57

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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 - Alpha-amino acid amide - 3-phenylpyrrolidine - Alpha-amino acid or derivatives - Indole or derivatives - Dihydroindole - Nitroaromatic compound - Benzoyl - Aryl alkyl ketone - Aralkylamine - Monocyclic benzene moiety - Beta-aminoketone - Gamma-aminoketone - Benzenoid - Pyrrole - Pyrrolidine - Amino acid or derivatives - Organic nitro compound - Carboxamide group - Secondary carboxylic acid amide - Lactam - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Sulfenyl compound - Thioether - Carboxylic acid derivative - Secondary aliphatic amine - Organoheterocyclic compound - Dialkylthioether - Organic 1,3-dipolar compound - Organic oxoazanium - Secondary amine - Organic salt - Hydrocarbon derivative - Organic oxide - Amine - Organonitrogen compound - Organosulfur compound - Organic zwitterion - Organic nitrogen compound - 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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