Structure Information
Structure

Compound Identification

SMILES

CC1=C2C=CSC2=C(O)C2=C1C(=O)OC2(C)C

InChIKey

InChIKey=QTLJOYYYJSTWRI-UHFFFAOYSA-N

Formula

C13H12O3S

Mass

248.3

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzofurans

Subclass

Benzofuranones

Intermediate Tree Nodes

Not available

Direct Parent

Benzofuranones

Alternative Parents

Phthalides 1-benzothiophenes Phenols Thiophenes Heteroaromatic compounds Lactones Carboxylic acid esters Oxacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzofuranone - Isobenzofuranone - Phthalide - Benzothiophene - Isocoumaran - 1-benzothiophene - Phenol - Benzenoid - Heteroaromatic compound - Thiophene - Carboxylic acid ester - Lactone - Carboxylic acid derivative - Oxacycle - Organooxygen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as benzofuranones. These are organic compounds containing a benzene ring fused to a furanone.

External Descriptors

Not available

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