Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC(=C(NC2C[C@H](OC3CCCCO3)[C@@](OCC=C)(C=O)C3=CC=CC=C23)C=C1)[N+]([O-])=O

InChIKey

InChIKey=JDPNFXTVMMXZLT-SIHRSVRCSA-N

Formula

C25H27N3O8

Mass

497.504

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Aniline and substituted anilines

Intermediate Tree Nodes

Not available

Direct Parent

Dinitroanilines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Dinitroaniline - Tetralin - Nitrobenzene - Phenylalkylamine - Nitroaromatic compound - Secondary aliphatic/aromatic amine - Aralkylamine - Oxane - C-nitro compound - Organic nitro compound - Oxacycle - Organoheterocyclic compound - Dialkyl ether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Ether - Acetal - Secondary amine - Organic oxoazanium - Aldehyde - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Organic zwitterion - Organic salt - Carbonyl group - Amine - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as dinitroanilines. These are organic compounds containing an aniline moiety, which is substituted at 2 positions by a nitro group.

External Descriptors

Not available

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