Compound Identification
SMILES
[Ni++].O=C1C=CC=C\C1=C\NCCN1CC1.O=C1C=CC=C\C1=C\NCCN1CC1
InChIKey
InChIKey=JWXQAHSLAHFXRH-CVBJKYQLSA-N
Formula
C22H28N4NiO2
Mass
439.184
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
Vinylogous amides Trialkylamines Organic transition metal salts Enamines Dialkylamines Aziridines Azacyclic compounds Allylamines Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Not available
Substituents
O-quinomethane - Vinylogous amide - Tertiary amine - Tertiary aliphatic amine - Aziridine - Secondary aliphatic amine - Enamine - Secondary amine - Allylamine - Organoheterocyclic compound - Organic transition metal salt - Azacycle - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Amine - Organic cation - 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