Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(NC2=CS(=O)(=O)CC2[N+]([O-])=O)C=C1

InChIKey

InChIKey=KPVQPEXNUZVRAA-UHFFFAOYSA-N

Formula

C11H12N2O4S

Mass

268.29

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Toluenes

Intermediate Tree Nodes

Not available

Direct Parent

Aminotoluenes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aniline or substituted anilines - Aminotoluene - 2,3-dihydrothiophene - Sulfone - C-nitro compound - Organic nitro compound - Enamine - Organic oxoazanium - Secondary amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Organic zwitterion - Organopnictogen compound - Organic nitrogen compound - Amine - Organic oxygen compound - Organic salt - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as aminotoluenes. These are organic aromatic compounds containing a benzene that carries a single methyl group and one amino group.

External Descriptors

Not available

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