Compound Identification
SMILES
CCC(CO)NC1=CC=C2N=CC(N2N1)=C1C=CC(=O)C=C1
InChIKey
InChIKey=IGNZCBRCKIQHMH-UHFFFAOYSA-N
Formula
C16H18N4O2
Mass
298.346
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
Pyridazines and derivatives N-substituted imidazoles Heteroaromatic compounds Ketene acetals Azacyclic compounds Primary alcohols Organic oxides Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
P-quinomethane - N-substituted imidazole - Pyridazine - Azole - Imidazole - Heteroaromatic compound - Ketene acetal or derivatives - Organoheterocyclic compound - Azacycle - Hydrocarbon derivative - Primary alcohol - Organic oxide - Organonitrogen compound - Organic nitrogen compound - Amine - Alcohol - Aromatic 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