Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C(C)NC(C)=C(C1C1=CC=C(C=C1)[N+](\[O-])=C\C1=CC=C(C=C1)[N+]([O-])=O)C(=O)OCC

InChIKey

InChIKey=WBUWEXHDWZRLPX-MBTHVWNTSA-N

Formula

C26H27N3O7

Mass

493.516

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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 - Nitroaromatic compound - Dihydropyridine - Dicarboxylic acid or derivatives - Hydropyridine - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Vinylogous amide - Carboxylic acid ester - C-nitro compound - Nitrone - Shiff base - Organic nitro compound - Organoheterocyclic compound - Azacycle - Organic 1,3-dipolar compound - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Secondary aliphatic amine - Enamine - Amine - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic zwitterion - 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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