Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(S[C@@H](CC(=O)C2=CC=C(C)C=C2)C([O-])=O)C=C1

InChIKey

InChIKey=IEIVEWHOYWOARU-KRWDZBQOSA-M

Formula

C18H17O3S

Mass

313.39

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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 homomonocyclic compounds

Substituents

Alkyl-phenylketone - Butyrophenone - Aryl thioether - Benzoyl - Aryl alkyl ketone - Thiophenol ether - Gamma-keto acid - Alkylarylthioether - Toluene - Thia fatty acid - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Keto acid - Carboxylic acid salt - Carboxylic acid derivative - Sulfenyl compound - Carboxylic acid - Thioether - Monocarboxylic acid or derivatives - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organic anion - Aromatic homomonocyclic 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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