Structure Information
Structure

Compound Identification

SMILES

CC(C)OC1=C(C=C(C=C1)[N+]([O-])=O)C(=O)NC1=NC2=NC3=CC=CC=C3N2C=C1C#N

InChIKey

InChIKey=ZSJAMKKWJPYYJE-UHFFFAOYSA-N

Formula

C21H16N6O4

Mass

416.397

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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

Nitrophenyl ethers

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Nitrophenyl ether - Benzamide - Benzimidazole - Imidazo[1,2-a]pyrimidine - Benzoic acid or derivatives - Phenoxy compound - Nitroaromatic compound - Benzoyl - Phenol ether - Alkyl aryl ether - N-substituted imidazole - Pyrimidine - Imidolactam - Azole - Imidazole - Heteroaromatic compound - Carboxamide group - C-nitro compound - Organic nitro compound - Secondary carboxylic acid amide - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Ether - Carbonitrile - Nitrile - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Azacycle - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Cyanide - Organic zwitterion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as nitrophenyl ethers. These are aromatic compounds containing a nitrobenzene moiety that carries an ether group on the benzene ring.

External Descriptors

Not available

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