Structure Information
Structure

Compound Identification

SMILES

CC(=O)OC(OC(C)=O)C1=CSC2=CC=CC=C12

InChIKey

InChIKey=NBHWONDCIOKBCI-UHFFFAOYSA-N

Formula

C13H12O4S

Mass

264.3

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Benzothiophenes

Subclass

1-benzothiophenes

Intermediate Tree Nodes

Not available

Direct Parent

1-benzothiophenes

Alternative Parents

Dicarboxylic acids and derivatives Benzenoids Thiophenes Heteroaromatic compounds Carboxylic acid esters Acetals Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-benzothiophene - Benzenoid - Dicarboxylic acid or derivatives - Heteroaromatic compound - Thiophene - Carboxylic acid ester - Carboxylic acid derivative - Acetal - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 1-benzothiophenes. These are aromatic heterocyclic compound containing the Benzo[b]thiophene ring system.

External Descriptors

Not available

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