Compound Identification
SMILES
CCOC(=O)C1=CC(C(=O)C(F)(F)F)=C(O)C(=C1)C(=O)C(F)(F)F
InChIKey
InChIKey=ZMCPLHZWJAHIDO-UHFFFAOYSA-N
Formula
C13H8F6O5
Mass
358.192
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
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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
p-Hydroxybenzoic acid alkyl esters Benzoyl derivatives Aryl alkyl ketones Phenols Vinylogous acids Alpha-haloketones Carboxylic acid esters Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - P-hydroxybenzoic acid alkyl ester - P-hydroxybenzoic acid ester - Benzoate ester - Benzoic acid or derivatives - Aryl alkyl ketone - Benzoyl - Phenol - Monocyclic benzene moiety - Benzenoid - Alpha-haloketone - Vinylogous acid - Carboxylic acid ester - Carboxylic acid derivative - Alkyl fluoride - Organohalogen compound - Organofluoride - Hydrocarbon derivative - Organic oxide - Alkyl halide - 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