Compound Identification
SMILES
CC1=C\C(NC=C1)=C1/C=CC(N)=CC1=O
InChIKey
InChIKey=QTPLTDIONYNNBR-KHPPLWFESA-N
Formula
C12H12N2O
Mass
200.241
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Cyclic ketones
-
Level 7
Quinomethanes
- Level 8 O-quinomethanes
-
Level 7
Quinomethanes
-
Level 6
Cyclic ketones
-
Level 5
Ketones
-
Subclass
Carbonyl compounds
-
Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Carbonyl compounds
Intermediate Tree Nodes
Ketones - Cyclic ketones - Quinomethanes
Direct Parent
O-quinomethanes
Alternative Parents
Dihydropyridines Vinylogous amides Enamines Dialkylamines Azacyclic compounds Allylamines Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
O-quinomethane - Dihydropyridine - Hydropyridine - Vinylogous amide - Secondary aliphatic amine - Enamine - Allylamine - Secondary amine - Organoheterocyclic compound - Azacycle - Primary aliphatic amine - Organonitrogen compound - Primary amine - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic oxide - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as o-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 2, respectively.
External Descriptors
Not available