Structure Information
Structure

Compound Identification

SMILES

CC1=NC(CC(=O)C2=C(O)C(O)=C(O)C=C2)=CS1

InChIKey

InChIKey=UFTIWWLDXALQEX-UHFFFAOYSA-N

Formula

C12H11NO4S

Mass

265.28

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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 - Benzenetriol - 5-unsubstituted pyrrogallol - Pyrogallol derivative - Benzoyl - Aryl alkyl ketone - 1-hydroxy-2-unsubstituted benzenoid - 2,4-disubstituted 1,3-thiazole - Phenol - 1-hydroxy-4-unsubstituted benzenoid - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Vinylogous acid - Thiazole - Organoheterocyclic compound - Azacycle - Polyol - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - 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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