Compound Identification
SMILES
Cl[Ti]Cl.N#CC1=CC=C(C=C1)N=CC1=CC=C[N-]1
InChIKey
InChIKey=NMTNDVPFSGXNMY-UHFFFAOYSA-L
Formula
C12H8Cl2N3Ti
Mass
312.98
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
Substituted pyrroles Heteroaromatic compounds Shiff bases Organic transition metal salts Nitriles Azacyclic compounds Hydrocarbon derivatives Organic anions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzonitrile - Substituted pyrrole - Pyrrole - Heteroaromatic compound - Shiff base - Aldimine - Carbonitrile - Nitrile - Azacycle - Organoheterocyclic compound - Organic transition metal salt - Organic metal salt - Cyanide - Hydrocarbon derivative - Imine - Organic nitrogen compound - Organonitrogen compound - Organic anion - 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