Structure Information
Structure

Compound Identification

SMILES

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

InChIKey

InChIKey=VKKONTUGWWOPHH-UHFFFAOYSA-N

Formula

C12H7BrN2O5S

Mass

371.16

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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

Phenyl sulfoxide - Nitrobenzene - Nitroaromatic compound - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - C-nitro compound - Sulfoxide - Organic nitro compound - Allyl-type 1,3-dipolar organic compound - Sulfinyl compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Organosulfur compound - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen 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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