Compound Identification
SMILES
[Na+].[O-]C(=O)CC(=O)NC12CC3CC(CC(C3)C1)C2
InChIKey
InChIKey=GDANDSSCONTRAJ-UHFFFAOYSA-M
Formula
C13H18NNaO3
Mass
259.281
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
Secondary carboxylic acid amides Carboxylic acid salts Monocarboxylic acids and derivatives Carboxylic acids Organonitrogen compounds Organic sodium salts Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aliphatic homopolycyclic compounds
Substituents
1,3-dicarbonyl compound - Carboxamide group - Carboxylic acid salt - Secondary carboxylic acid amide - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic alkali metal salt - Hydrocarbon derivative - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Organic salt - Organic sodium salt - Organic cation - Aliphatic homopolycyclic 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