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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzonitriles
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzonitriles
Intermediate Tree Nodes
Not available
Direct Parent
Benzonitriles
Alternative Parents
Dialkylarylamines Aniline and substituted anilines Aminopyrimidines and derivatives 1-hydroxy-4-unsubstituted benzenoids 1-hydroxy-2-unsubstituted benzenoids Morpholines Imidolactams Heteroaromatic compounds Oxacyclic compounds Nitriles Dialkyl ethers Azacyclic compounds Hydrocarbon derivatives
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