Compound Identification
SMILES
Cl.N#CC1=CC=CC=C1N=CC1=CC=NC=C1
InChIKey
InChIKey=XKZIYOHGFMVFFH-UHFFFAOYSA-N
Formula
C13H10ClN3
Mass
243.69
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
Pyridines and derivatives Heteroaromatic compounds Shiff bases Propargyl-type 1,3-dipolar organic compounds Nitriles Azacyclic compounds Hydrochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzonitrile - Pyridine - Heteroaromatic compound - Shiff base - Aldimine - Carbonitrile - Nitrile - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Azacycle - Cyanide - Hydrocarbon derivative - Imine - Organic nitrogen compound - Hydrochloride - Organonitrogen compound - 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