Structure Information
Structure

Compound Identification

SMILES

OC1=CC=CC(=C1)C1=NC(=CC(NC2=CC=C(C=C2)C#N)=N1)N1CCOCC1

InChIKey

InChIKey=JYVMJHVMVNRVGV-UHFFFAOYSA-N

Formula

C21H19N5O2

Mass

373.416

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzonitriles

Intermediate Tree Nodes

Not available

Direct Parent

Benzonitriles

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzonitrile - Dialkylarylamine - Aniline or substituted anilines - Aminopyrimidine - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Morpholine - Oxazinane - Pyrimidine - Imidolactam - Heteroaromatic compound - Organoheterocyclic compound - Nitrile - Carbonitrile - Ether - Dialkyl ether - Azacycle - Oxacycle - Organic oxygen compound - Cyanide - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzonitriles. These are organic compounds containing a benzene bearing a nitrile substituent.

External Descriptors

Not available

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