Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=NOC(C2CC2)=C1C(=O)C1=C(C=C(C=C1)S(C)(=O)=O)[N+]([O-])=O

InChIKey

InChIKey=CXMPSYZPHZYVQA-UHFFFAOYSA-N

Formula

C17H16N2O8S

Mass

408.38

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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

Aryl-phenylketones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aryl-phenylketone - Benzenesulfonyl group - Nitrobenzene - 5-cyclopropylisoxazole - Cyclopropylisoxazole - Nitroaromatic compound - Benzoyl - Monocyclic benzene moiety - Benzenoid - Azole - Isoxazole - Sulfone - Sulfonyl - Heteroaromatic compound - Organic nitro compound - Carboxylic acid ester - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Oxacycle - Azacycle - Organoheterocyclic compound - Organic oxoazanium - Organic zwitterion - Hydrocarbon derivative - Organonitrogen compound - Organic salt - Organosulfur compound - Organic nitrogen compound - Organic oxide - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as aryl-phenylketones. These are aromatic compounds containing a ketone substituted by one aryl group, and a phenyl group.

External Descriptors

Not available

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