Compound Identification
SMILES
COC(=O)CCC(=O)C1=CC(F)=C(NC(=O)CCl)C=C1
InChIKey
InChIKey=QSKYBNQNAIYSRQ-UHFFFAOYSA-N
Formula
C13H13ClFNO4
Mass
301.7
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
Butyrophenones Anilides Aryl alkyl ketones Benzoyl derivatives Gamma-keto acids and derivatives N-arylamides Fluorobenzenes Fatty acid methyl esters Aryl fluorides Methyl esters Chloroacetamides Secondary carboxylic acid amides Monocarboxylic acids and derivatives Hydrocarbon derivatives Alkyl chlorides Organofluorides Organic oxides Organochlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Butyrophenone - Anilide - Gamma-keto acid - Benzoyl - N-arylamide - Aryl alkyl ketone - Halobenzene - Fluorobenzene - Fatty acid ester - Fatty acid methyl ester - Monocyclic benzene moiety - Aryl halide - Aryl fluoride - Keto acid - Benzenoid - Fatty acyl - Chloroacetamide - Methyl ester - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organofluoride - Alkyl halide - Organonitrogen compound - Alkyl chloride - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organochloride - Organohalogen compound - 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