Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC=CC(=C1)C(=O)NNC1=NC=NC(NC2=NC=C(Br)C=C2)=C1[N+]([O-])=O

InChIKey

InChIKey=GTZUFNGEEHYCMJ-UHFFFAOYSA-N

Formula

C16H11BrN8O5

Mass

475.219

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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

Benzoic acid or derivatives - Nitrobenzene - Nitroaromatic compound - Benzoyl - Aminopyridine - Aminopyrimidine - Aryl bromide - Aryl halide - Imidolactam - Pyridine - Pyrimidine - Heteroaromatic compound - Amino acid or derivatives - Organic nitro compound - Carboxylic acid hydrazide - C-nitro compound - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Secondary amine - Organic oxide - Organic oxygen compound - Organic salt - Hydrocarbon derivative - Organohalogen compound - Amine - Organobromide - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Organic nitrogen compound - 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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