Structure Information
Structure

Compound Identification

SMILES

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

InChIKey

InChIKey=KEKKWOSLHBTMCU-UHFFFAOYSA-N

Formula

C12H16N2O5S

Mass

300.33

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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

Nitrobenzene - Nitroaromatic compound - Fatty amide - Fatty acyl - Sulfinic acid - Carboxamide group - C-nitro compound - Primary carboxylic acid amide - Sulfinic acid derivative - Alkanesulfinic acid or derivatives - Alkanesulfinic acid - Organic nitro compound - Carboxylic acid derivative - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic salt - Hydrocarbon derivative - Organic oxygen compound - Organic cation - 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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