Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C(CC(=O)C1=CC2=CC=CC=C2S1)C(=O)OCC

InChIKey

InChIKey=HOEFXCFWCXUYSP-UHFFFAOYSA-N

Formula

C17H18O5S

Mass

334.39

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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

Gamma-keto acids and derivatives Aryl alkyl ketones 2,3,5-trisubstituted thiophenes Fatty acid esters Dicarboxylic acids and derivatives Benzenoids 1,3-dicarbonyl compounds Heteroaromatic compounds Carboxylic acid esters Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-benzothiophene - Gamma-keto acid - 2,3,5-trisubstituted thiophene - Aryl ketone - Aryl alkyl ketone - Fatty acid ester - Dicarboxylic acid or derivatives - Keto acid - 1,3-dicarbonyl compound - Benzenoid - Fatty acyl - Thiophene - Heteroaromatic compound - Ketone - Carboxylic acid ester - Carboxylic acid derivative - Organooxygen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - 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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