Compound Identification
SMILES
CC(C)CCCOC1=CC=CC(=O)\C1=C1\NC(N)=C(C#N)C(=C1)C1CCNCC1
InChIKey
InChIKey=WJAXCQIKJNEHJW-QOCHGBHMSA-N
Formula
C23H30N4O2
Mass
394.519
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
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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
O-quinomethanes
Alternative Parents
Dihydropyridines Piperidines Vinylogous amides Ketene acetals Nitriles Dialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
O-quinomethane - Dihydropyridine - Hydropyridine - Piperidine - Vinylogous amide - Ketene acetal or derivatives - Secondary aliphatic amine - Carbonitrile - Nitrile - Azacycle - Secondary amine - Organoheterocyclic compound - Amine - Hydrocarbon derivative - Organonitrogen compound - Organic nitrogen compound - Cyanide - 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