Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC(=CNCC2=CC=CS2)C(=O)C=C1

InChIKey

InChIKey=NQRGTGJIJRIUSB-UHFFFAOYSA-N

Formula

C12H10N2O3S

Mass

262.28

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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

O-quinomethanes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

O-quinomethane - Aralkylamine - Thiophene - Heteroaromatic compound - Vinylogous amide - C-nitro compound - Organic nitro compound - Secondary aliphatic amine - Enamine - Allylamine - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic salt - Amine - Organonitrogen compound - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as o-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 2, respectively.

External Descriptors

Not available

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