Structure Information
Structure

Compound Identification

SMILES

[O-]C(=O)\C=C/C([O-])=O.[O-][N+](=O)C1=CC=CC=CS1

InChIKey

InChIKey=KAKLIYJIMIYOAP-BTJKTKAUSA-L

Formula

C10H7NO6S

Mass

269.23

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Thiepins

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Thiepins

Alternative Parents

Molecular Framework

Not available

Substituents

Thiepin - Dicarboxylic acid or derivatives - Unsaturated fatty acid - Fatty acid - Fatty acyl - Carboxylic acid salt - Organic nitro compound - Ketene acetal or derivatives - Thioenolether - C-nitro compound - Carboxylic acid derivative - Carboxylic acid - Organic oxoazanium - Organic oxygen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Organic salt - Hydrocarbon derivative - Organic cation - Aliphatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as thiepins. These are heterocyclic compounds containing an unsaturated seven-member heterocycle, with six carbon atoms and one sulfur atom.

External Descriptors

Not available

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