Structure Information
Structure

Compound Identification

SMILES

CCC1=C(OCC2=CC=CC(=C2)C(=O)NC2=NC(CC(O)=O)=CS2)C=C(O)C(=C1)C(C)=O

InChIKey

InChIKey=KTAZNYBNDXJODL-UHFFFAOYSA-N

Formula

C23H22N2O6S

Mass

454.5

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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 - Acetophenone - Benzamide - Benzoic acid or derivatives - Phenoxy compound - Benzoyl - Phenol ether - Aryl alkyl ketone - 2,4-disubstituted 1,3-thiazole - 1-hydroxy-2-unsubstituted benzenoid - Alkyl aryl ether - Phenol - Benzenoid - Monocyclic benzene moiety - Thiazole - Vinylogous acid - Heteroaromatic compound - Azole - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid derivative - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Azacycle - Carboxylic acid - Ether - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - 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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