Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC=C1\C=N\NC1=NC(NC2=CC=C(C=C2)[N+]([O-])=O)=NC(NC2=CC(C)=C(C)C=C2)=N1

InChIKey

InChIKey=DUTBTNVIFZSZGT-CVKSISIWSA-N

Formula

C25H24N8O3

Mass

484.52

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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 - Phenoxy compound - 2,4-diamine-s-triazine - Nitroaromatic compound - O-xylene - Xylene - Anisole - Phenol ether - Methoxybenzene - Aniline or substituted anilines - Alkyl aryl ether - Amino-1,3,5-triazine - Aminotriazine - Triazine - 1,3,5-triazine - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Organoheterocyclic compound - Ether - Hydrazone - Organic oxoazanium - Azacycle - Secondary amine - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Organic zwitterion - Organic oxygen compound - Organic salt - 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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