Compound Identification
SMILES
O=C1C=CC(C=C1)=C1NC=CC(CN2[C@H]3CC[C@@H]2CN(CC2=CC(NC=C2)=C2C=CC(=O)C=C2)C3)=C1
InChIKey
InChIKey=NZIIVVXWKDWZTA-WMPKNSHKSA-N
Formula
C30H30N4O2
Mass
478.596
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 P-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
P-quinomethanes
Alternative Parents
N-alkylpiperazines Dihydropyridines Azepanes N-alkylpyrrolidines Trialkylamines Enamines Dialkylamines Azacyclic compounds Allylamines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
P-quinomethane - Azepane - Dihydropyridine - N-alkylpiperazine - 1,4-diazinane - Hydropyridine - Piperazine - N-alkylpyrrolidine - Pyrrolidine - Tertiary aliphatic amine - Tertiary amine - Secondary amine - Allylamine - Enamine - Secondary aliphatic amine - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Organonitrogen compound - Amine - Organic oxide - Hydrocarbon derivative - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as p-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 4, respectively.
External Descriptors
Not available