Compound Identification
SMILES
NCCN(CCN)CCNC=C1C=CC=CC1=O
InChIKey
InChIKey=AYZOXTWHBFWNKQ-UHFFFAOYSA-N
Formula
C13H22N4O
Mass
250.346
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 O-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
O-quinomethanes
Alternative Parents
Vinylogous amides Trialkylamines Enamines Dialkylamines Allylamines Organic oxides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
O-quinomethane - Vinylogous amide - Tertiary aliphatic amine - Tertiary amine - Secondary aliphatic amine - Enamine - Allylamine - Secondary amine - Amine - Primary amine - Organonitrogen compound - Hydrocarbon derivative - Primary aliphatic amine - Organic oxide - Organic nitrogen compound - Aliphatic homomonocyclic 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