Structure Information
Structure

Compound Identification

SMILES

[Ni++].CC\C(=N/NC1=C(C=C(C=C1)[N+]([O-])=O)[N+]([O-])=O)C1=CC2=C(CC)C(CC)=C([N-]2)C=C2N=C(C=C3[N-]C(=CC(=N1)C(\CC)=N\NC1=C(C=C(C=C1)[N+]([O-])=O)[N+]([O-])=O)C(CC)=C3CC)C(CC)=C2CC

InChIKey

InChIKey=FDOVHRNNJPLIEU-BHKUQVNGSA-N

Formula

C48H52N12NiO8

Mass

983.713

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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 - Phenylhydrazine - Substituted pyrrole - Pyrrole - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Azacycle - Organic transition metal salt - Organoheterocyclic compound - Hydrazone - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Organic zwitterion - Organic salt - 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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