Compound Identification
SMILES
CCC(C(C1=CC=C(O)C=C1)=C1C=CC(=O)C=C1)=C1C=CNC=C1
InChIKey
InChIKey=KHHUNKCRTVUNMJ-UHFFFAOYSA-N
Formula
C21H19NO2
Mass
317.388
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
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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
Dihydropyridines 1-hydroxy-2-unsubstituted benzenoids Benzene and substituted derivatives Enamines Dialkylamines Azacyclic compounds Allylamines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
P-quinomethane - Dihydropyridine - Phenol - 1-hydroxy-2-unsubstituted benzenoid - Benzenoid - Hydropyridine - Monocyclic benzene moiety - Azacycle - Organoheterocyclic compound - Enamine - Secondary aliphatic amine - Allylamine - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Amine - Organic oxide - Aromatic heteromonocyclic 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