Structure Information
Structure

Compound Identification

SMILES

COC1=C(C=C(Cl)C=C1)C1=NN=C(O1)SCC(=O)C1=CC=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=YFCVGGFLRYRADE-UHFFFAOYSA-N

Formula

C17H12ClN3O5S

Mass

405.81

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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 - Phenol ether - Phenoxy compound - Aryl thioether - Nitroaromatic compound - Anisole - Aryl alkyl ketone - Benzoyl - Methoxybenzene - Alkyl aryl ether - Halobenzene - Chlorobenzene - Alkylarylthioether - Benzenoid - Aryl chloride - Monocyclic benzene moiety - Aryl halide - 1,3,4-oxadiazole - Heteroaromatic compound - Oxadiazole - Azole - Organic nitro compound - C-nitro compound - Thioether - Sulfenyl compound - Oxacycle - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Ether - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic salt - Organohalogen compound - Organochloride - Organonitrogen compound - Organosulfur compound - 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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