Compound Identification
SMILES
COC(=O)C1CC(CCC1=O)([N+]([O-])=O)C(F)(F)F
InChIKey
InChIKey=CTQFRXRLGTVZKC-UHFFFAOYSA-N
Formula
C9H10F3NO5
Mass
269.176
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
Methyl esters Cyclic ketones C-nitro compounds Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Monocarboxylic acids and derivatives Organonitrogen compounds Organofluorides Organic salts Organic oxides Hydrocarbon derivatives Alkyl fluorides Organic cations
Molecular Framework
Aliphatic homomonocyclic compounds
Substituents
1,3-dicarbonyl compound - Methyl ester - Carboxylic acid ester - Ketone - C-nitro compound - Organic nitro compound - Cyclic ketone - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organofluoride - Alkyl halide - Organohalogen compound - Hydrocarbon derivative - Alkyl fluoride - Organonitrogen compound - Organic salt - Organic nitrogen compound - Organic oxide - Organic cation - 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