Compound Identification
SMILES
CC(C)(C)N1N(C(=O)C(C#N)C1=O)C(C)(C)C
InChIKey
InChIKey=QNXIGUWKWMTVEO-UHFFFAOYSA-N
Formula
C12H19N3O2
Mass
237.303
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
- Level 5 1,3-dicarbonyl compounds
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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
Not available
Direct Parent
1,3-dicarbonyl compounds
Alternative Parents
Pyrazolidinones Carboxylic acid hydrazides Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
1,3-dicarbonyl compound - Pyrazolidinone - Pyrazolidine - Carboxylic acid hydrazide - Azacycle - Organoheterocyclic compound - Nitrile - Carbonitrile - Carboxylic acid derivative - Organic nitrogen compound - Cyanide - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 1,3-dicarbonyl compounds. These are carbonyl compounds with the generic formula O=C(R)C(H)C(R')=O, where R and R' can be any group.
External Descriptors
Not available