Compound Identification
SMILES
NC1=NC(=C\C(N1)=C1/C=C(C=CC1=O)C1=NC(N)=NC=C1)N1CCNCC1
InChIKey
InChIKey=IISUQDYKQRXLTK-OWBHPGMISA-N
Formula
C18H20N8O
Mass
364.413
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
Aminopyrimidines and derivatives Piperazines Hydropyrimidines Vinylogous amides Heteroaromatic compounds Ketene acetals Guanidines Propargyl-type 1,3-dipolar organic compounds Dialkylamines Carboximidamides Azacyclic compounds Primary amines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
O-quinomethane - Aminopyrimidine - 1,4-diazinane - Hydropyrimidine - 1,6-dihydropyrimidine - Piperazine - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Ketene acetal or derivatives - Guanidine - Carboximidamide - Secondary amine - Organoheterocyclic compound - Azacycle - Secondary aliphatic amine - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic nitrogen compound - Primary amine - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Aromatic 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