Structure Information
Structure

Compound Identification

SMILES

OCCN1C(SCC(=O)C2=CC=CC=C2)=NC2=C1C=CC(=C2)[N+]([O-])=O

InChIKey

InChIKey=KFWVJBQXLTZTDB-UHFFFAOYSA-N

Formula

C17H15N3O4S

Mass

357.38

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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 - Benzimidazole - Aryl thioether - Nitroaromatic compound - Benzoyl - Aryl alkyl ketone - Alkylarylthioether - Monocyclic benzene moiety - N-substituted imidazole - Benzenoid - Heteroaromatic compound - Azole - Imidazole - Organic nitro compound - C-nitro compound - Organoheterocyclic compound - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Thioether - Alkanolamine - Organic oxoazanium - Hydrocarbon derivative - Organonitrogen compound - Organosulfur compound - Primary alcohol - Organopnictogen compound - Organic nitrogen compound - Alcohol - Organic zwitterion - Organic oxide - 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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