Compound Identification
SMILES
CNC=C1C(=O)CC(C)(C)C(C(=O)OC)C1=O
InChIKey
InChIKey=ZAQQQXVFSFKFHV-UHFFFAOYSA-N
Formula
C12H17NO4
Mass
239.271
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
Vinylogous amides Methyl esters Cyclic ketones Monocarboxylic acids and derivatives Enamines Dialkylamines Allylamines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
1,3-dicarbonyl compound - Methyl ester - Vinylogous amide - Carboxylic acid ester - Ketone - Cyclic ketone - Carboxylic acid derivative - Secondary aliphatic amine - Enamine - Monocarboxylic acid or derivatives - Allylamine - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Aliphatic homomonocyclic 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