Structure Information
Structure

Compound Identification

SMILES

CSC1=CC(=C(C=C1)S(=O)(=O)CC(=O)NC1CCS(=O)(=O)C1)[N+]([O-])=O

InChIKey

InChIKey=ZQLZYLIZSOFFSA-UHFFFAOYSA-N

Formula

C13H16N2O7S3

Mass

408.46

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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 heteromonocyclic compounds

Substituents

Nitrobenzene - Benzenesulfonyl group - Aryl thioether - Nitroaromatic compound - Thiophenol ether - Alkylarylthioether - Sulfone - Sulfonyl - Thiolane - Carboxamide group - C-nitro compound - Secondary carboxylic acid amide - Organic nitro compound - Carboxylic acid derivative - Organic oxoazanium - Organoheterocyclic compound - Thioether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Sulfenyl compound - Allyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organic nitrogen compound - Organic salt - Organic oxygen compound - Organic oxide - Carbonyl group - Organonitrogen compound - Organic cation - Aromatic heteromonocyclic 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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