Compound Identification
SMILES
OCC1(CCCC1)\N=C\[C@@H](C(O)=O)C(=O)c1cc(F)c(F)c(F)c1F
InChIKey
InChIKey=REBGONNDGFHQTC-IMJGGNRESA-N
Formula
C16H15F4NO4
Mass
361.293
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
-
Subclass
Carbonyl compounds
-
Level 5
Ketones
-
Level 6
Aryl ketones
-
Level 7
Phenylketones
- Level 8 Alkyl-phenylketones
-
Level 7
Phenylketones
-
Level 6
Aryl 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 - Aryl ketones - Phenylketones
Direct Parent
Alkyl-phenylketones
Alternative Parents
Phenylpropanoic acids Aryl alkyl ketones Benzoyl derivatives Beta-keto acids and derivatives Fluorobenzenes 1,3-dicarbonyl compounds Aryl fluorides Beta-hydroxy ketones Vinylogous halides Shiff bases Carboxylic acids Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Hydrocarbon derivatives Primary alcohols Organic oxides Organofluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - 3-phenylpropanoic-acid - Aryl alkyl ketone - Benzoyl - Beta-keto acid - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - 1,3-dicarbonyl compound - Beta-hydroxy ketone - Keto acid - Vinylogous halide - Shiff base - Aldimine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic nitrogen compound - Primary alcohol - Alcohol - Organic oxide - Organonitrogen compound - Organofluoride - Imine - Organohalogen compound - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.
External Descriptors
Not available