Compound Identification
SMILES
OC(=O)CCCCCCN1[C@@H](CCC(=O)C2=CC(=CC=C2)C(F)(F)F)CCC1=O
InChIKey
InChIKey=RFKBUOOIXPMTCS-KRWDZBQOSA-N
Formula
C21H26F3NO4
Mass
413.437
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 Trifluoromethylbenzenes Aryl alkyl ketones Benzoyl derivatives Medium-chain fatty acids Halogenated fatty acids Heterocyclic fatty acids Pyrrolidine-2-ones N-alkylpyrrolidines Tertiary carboxylic acid amides Amino acids Tertiary amines Lactams Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Organofluorides Alkyl fluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Butyrophenone - Trifluoromethylbenzene - Medium-chain fatty acid - Aryl alkyl ketone - Benzoyl - Heterocyclic fatty acid - Halogenated fatty acid - Fatty acyl - Fatty acid - Benzenoid - N-alkylpyrrolidine - 2-pyrrolidone - Pyrrolidone - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Pyrrolidine - Amino acid or derivatives - Carboxamide group - Lactam - Tertiary amine - Amino acid - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Amine - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Aromatic heteromonocyclic 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