Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC=C(C=NNC(=O)C2=C(I)C=NN2)C=C1

InChIKey

InChIKey=BBUQWJYSZGDRRY-UHFFFAOYSA-N

Formula

C11H8IN5O3

Mass

385.121

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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 - Nitroaromatic compound - Pyrazole-5-carboxamide - Aryl halide - Aryl iodide - Azole - Heteroaromatic compound - Pyrazole - Vinylogous halide - C-nitro compound - Organic nitro compound - Carboxylic acid derivative - Organic oxoazanium - Azacycle - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Organonitrogen compound - Organoiodide - Organic nitrogen compound - Organohalogen compound - Organooxygen compound - Organic oxygen compound - Organic zwitterion - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - 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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