Structure Information
Structure

Compound Identification

SMILES

CC1=C(NS(=O)C2=CC=CC=C2)C=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=DLSSHWMDTQVPKX-UHFFFAOYSA-N

Formula

C13H12N2O3S

Mass

276.31

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Nitrobenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Nitrobenzenes

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Nitrotoluene - Nitrobenzene - Nitroaromatic compound - Toluene - Organic nitro compound - Aminosulfinyl compound - Sulfinic acid derivative - Sulfinic acid amide - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Sulfinyl compound - Organic oxoazanium - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic zwitterion - Organosulfur compound - Organonitrogen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.

External Descriptors

Not available

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