Compound Identification
SMILES
CC(N1C=NC=C1CNC1CCCCC(=C1)C1=CC=CC=C1C)C1=CC=C(C=C1)C#N
InChIKey
InChIKey=AFVIVMFYKNYQLQ-UHFFFAOYSA-N
Formula
C27H30N4
Mass
410.565
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzonitriles
-
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
Toluenes Aralkylamines N-substituted imidazoles Heteroaromatic compounds Nitriles Dialkylamines Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzonitrile - Aralkylamine - Toluene - N-substituted imidazole - Azole - Imidazole - Heteroaromatic compound - Secondary aliphatic amine - Azacycle - Carbonitrile - Nitrile - Secondary amine - Organoheterocyclic compound - Organic nitrogen compound - Cyanide - 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