Compound Identification
SMILES
CC(NC(CC(=O)C1=CC=C(F)C=C1)C(O)=O)C1=CC=CC=C1
InChIKey
InChIKey=KSHWGVIVSLPHCE-UHFFFAOYSA-N
Formula
C18H18FNO3
Mass
315.344
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
Butyrophenones Alpha amino acids Aryl alkyl ketones Gamma-keto acids and derivatives Benzoyl derivatives Aralkylamines Fluorobenzenes Aryl fluorides Beta-amino ketones Amino acids Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Hydrocarbon derivatives Organic oxides Organofluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - Butyrophenone - Alpha-amino acid - Alpha-amino acid or derivatives - Benzoyl - Aryl alkyl ketone - Gamma-keto acid - Aralkylamine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Beta-aminoketone - Benzenoid - Keto acid - Amino acid or derivatives - Amino acid - Secondary aliphatic amine - Carboxylic acid - Carboxylic acid derivative - Secondary amine - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Amine - Organic oxide - Organonitrogen compound - Organic nitrogen compound - Organohalogen compound - Organofluoride - 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