Structure Information
Structure

Compound Identification

SMILES

OC(=O)\C=C\C(O)=O.CN(CCO)CCCOCCC1=CC2=C(SC=C2)C=C1.CN(CCO)CCCOCCC1=CC2=C(SC=C2)C=C1

InChIKey

InChIKey=PCXLXJFDUOJTHL-WXXKFALUSA-N

Formula

C36H50N2O8S2

Mass

702.92

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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

Unsaturated fatty acids Dicarboxylic acids and derivatives Benzenoids Thiophenes Heteroaromatic compounds Trialkylamines 1,2-aminoalcohols Dialkyl ethers Carboxylic acids Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds

Molecular Framework

Not available

Substituents

1-benzothiophene - Dicarboxylic acid or derivatives - Fatty acyl - Fatty acid - Benzenoid - Unsaturated fatty acid - Thiophene - Heteroaromatic compound - 1,2-aminoalcohol - Tertiary amine - Tertiary aliphatic amine - Alkanolamine - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Organic oxygen compound - Amine - Organic nitrogen compound - Alcohol - Carbonyl group - Organonitrogen compound - Organooxygen compound - Primary alcohol - Organic oxide - 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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