Structure Information
Structure

Compound Identification

SMILES

N\C(S)=C1\C=CC(=O)C=C1[N+]([O-])=O

InChIKey

InChIKey=MOSWUSMTYIHBQU-FNORWQNLSA-N

Formula

C7H6N2O3S

Mass

198.2

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Cyclic ketones - Quinomethanes

Direct Parent

P-quinomethanes

Alternative Parents

Molecular Framework

Aliphatic homomonocyclic compounds

Substituents

P-quinomethane - Ketene acetal or derivatives - C-nitro compound - Organic nitro compound - Alkylthiol - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organic zwitterion - Organosulfur compound - Organonitrogen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Aliphatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as p-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 4, respectively.

External Descriptors

Not available

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