Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C[C@H]1[C@@H](C=CN(CC2=CC=CC=C2)C1=O)C1=CC=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=NPYYQEYQSFHBIR-PMACEKPBSA-N

Formula

C22H22N2O5

Mass

394.427

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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 - Tetrahydropyridine - Hydropyridine - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Lactam - C-nitro compound - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Organic oxoazanium - Carbonyl group - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxide - Organic salt - 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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