Compound Identification
SMILES
OC(=O)[C@H](CC(=O)C1=CC=C(F)C=C1)NCC1=CC=C(Cl)C=C1
InChIKey
InChIKey=BKMBIMIIKARZJE-HNNXBMFYSA-N
Formula
C17H15ClFNO3
Mass
335.76
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 L-alpha-amino acids Phenylmethylamines Aryl alkyl ketones Benzoyl derivatives Gamma-keto acids and derivatives Benzylamines Aralkylamines Fluorobenzenes Chlorobenzenes Aryl chlorides Aryl fluorides Beta-amino ketones Amino acids Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Organopnictogen compounds Organic oxides Hydrocarbon derivatives Organofluorides Organochlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Butyrophenone - Alpha-amino acid - Alpha-amino acid or derivatives - L-alpha-amino acid - Benzoyl - Benzylamine - Gamma-keto acid - Aryl alkyl ketone - Phenylmethylamine - Chlorobenzene - Fluorobenzene - Aralkylamine - Halobenzene - Benzenoid - Keto acid - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Beta-aminoketone - Amino acid or derivatives - Amino acid - Secondary amine - Monocarboxylic acid or derivatives - Secondary aliphatic amine - Carboxylic acid - Carboxylic acid derivative - Organochloride - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organopnictogen compound - Amine - Organofluoride - Organonitrogen compound - 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