Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(C)NC2=C(C1C1=C(Cl)C=CC(=C1)[N+]([O-])=O)S(=O)(=O)CCS(=O)(=O)C2

InChIKey

InChIKey=YFBFLYUYPQVTNZ-UHFFFAOYSA-N

Formula

C17H17ClN2O8S2

Mass

476.9

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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 heteropolycyclic compounds

Substituents

Nitrobenzene - Nitroaromatic compound - Halobenzene - Dihydropyridine - Chlorobenzene - Aryl chloride - Aryl halide - Sulfone - Methyl ester - Vinylogous amide - Enoate ester - Alpha,beta-unsaturated carboxylic ester - C-nitro compound - Carboxylic acid ester - Organic nitro compound - Secondary aliphatic amine - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Azacycle - Enamine - Carboxylic acid derivative - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Amine - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Organic cation - Aromatic heteropolycyclic 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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