Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC=C(C=C1)S(=O)(=O)C1=CN=C(NC(=O)COC(=O)C(=CC2=CC=CS2)C2=CC=CS2)S1

InChIKey

InChIKey=ADKGDRRJKQJAGU-UHFFFAOYSA-N

Formula

C22H15N3O7S4

Mass

561.62

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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

Benzenesulfonyl group - Nitrobenzene - Nitroaromatic compound - N-arylamide - 2,5-disubstituted 1,3-thiazole - Fatty acid ester - Fatty acyl - Azole - Heteroaromatic compound - Sulfone - Sulfonyl - Thiazole - Thiophene - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxamide group - Carboxylic acid ester - C-nitro compound - Secondary carboxylic acid amide - Organic nitro compound - Organoheterocyclic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxoazanium - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organic oxide - Organooxygen compound - Organic salt - Organosulfur compound - Organic zwitterion - Carbonyl group - 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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