Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC=C(C[N+]2(CCCCCCCCCC[N+]3(CC4=CC=C(C=C4)[N+]([O-])=O)CCN(CC3)C(=O)C3=CC=CC=C3)CCN(CC2)C(=O)C2=CC=CC=C2)C=C1

InChIKey

InChIKey=LHEXKUWKVVXINN-UHFFFAOYSA-N

Formula

C46H58N6O6

Mass

791.005

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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

Benzamide - Benzoic acid or derivatives - Nitrobenzene - Nitroaromatic compound - Benzoyl - Benzylamine - Phenylmethylamine - N-alkylpiperazine - Aralkylamine - 1,4-diazinane - Piperazine - Tertiary carboxylic acid amide - Quaternary ammonium salt - Tetraalkylammonium salt - Organic nitro compound - Carboxamide group - C-nitro compound - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Organic oxoazanium - Organic salt - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic oxygen compound - Organic cation - 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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