Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(CCC1)S(=O)CC1=CC=CC=C1

InChIKey

InChIKey=GMAGXXXQYNYLJO-UHFFFAOYSA-N

Formula

C14H16O3S

Mass

264.34

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzyl sulfoxides

Intermediate Tree Nodes

Not available

Direct Parent

Benzyl sulfoxides

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Benzyl sulfoxide - Methyl ester - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carboxylic acid ester - Sulfoxide - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Sulfinyl compound - Organosulfur compound - Organooxygen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzyl sulfoxides. These are organosulfur compounds that contain a sulfoxide group substituted by a benzyl group. They have the general structure RS(=O)R' ( R=benzyl, R'=organyl).

External Descriptors

Not available

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