Structure Information
Structure

Compound Identification

SMILES

OCCCNCCN(CC1=CC(=CC=C1)[N+]([O-])=O)CC1=CC=CC(CN(CC2=CC(=CC=C2)[N+]([O-])=O)CC2=CC(=CC=C2)[N+]([O-])=O)=N1

InChIKey

InChIKey=MPJIBMOXDFIANN-UHFFFAOYSA-N

Formula

C33H37N7O7

Mass

643.701

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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

6-substituted-2-pyridinylmethylamine - Nitrobenzene - 2-pyridylmethylamine - Nitroaromatic compound - Benzylamine - Phenylmethylamine - Aralkylamine - Pyridine - 1,3-aminoalcohol - Heteroaromatic compound - C-nitro compound - Tertiary amine - Tertiary aliphatic amine - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Alkanolamine - Organoheterocyclic compound - Secondary amine - Organic 1,3-dipolar compound - Secondary aliphatic amine - Organic oxoazanium - Amine - Organooxygen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Primary alcohol - Organic oxygen compound - Hydrocarbon derivative - Alcohol - Organic zwitterion - 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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