Compound Identification
SMILES
CC1=CC=CC=C1\C(N=O)=C1/C=C\C(\C=C1Cl)=N/C1=CNC=CN1
InChIKey
InChIKey=LPWXWSXJWNDAQJ-LSDNQSPLSA-N
Formula
C18H15ClN4O
Mass
338.8
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Toluenes
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Toluenes
Intermediate Tree Nodes
Not available
Direct Parent
Toluenes
Alternative Parents
Secondary ketimines Azomethines Vinyl chlorides Propargyl-type 1,3-dipolar organic compounds Enamines Dialkylamines Chloroalkenes C-nitroso compounds Azacyclic compounds Organopnictogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Toluene - Azomethine - Secondary ketimine - Ketimine - Organic nitroso compound - C-nitroso compound - Secondary aliphatic amine - Enamine - Secondary amine - Vinyl chloride - Vinyl halide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Haloalkene - Azacycle - Chloroalkene - Organopnictogen compound - Imine - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Amine - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as toluenes. These are compounds containing a benzene ring which bears a methane group.
External Descriptors
Not available