Structure Information
Structure

Compound Identification

SMILES

CS(=O)(=O)OCCN(CCOS(C)(=O)=O)C1=CC=C(C=NNC2=C(C=C(C=C2)[N+]([O-])=O)[N+]([O-])=O)C=C1

InChIKey

InChIKey=IHDJAOSOHWMBRL-UHFFFAOYSA-N

Formula

C19H23N5O10S2

Mass

545.54

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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 - Tertiary aliphatic/aromatic amine - Phenylhydrazine - Dialkylarylamine - Aniline or substituted anilines - Nitroaromatic compound - Organosulfonic acid ester - Sulfonic acid ester - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Methanesulfonate - Sulfonyl - Tertiary amine - Organic nitro compound - C-nitro compound - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Hydrazone - Amine - Organic zwitterion - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen 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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