Compound Identification
SMILES
FC(F)(F)C(=O)C(C(=O)C1=CC2=C(OCO2)C=C1)C12CC3CC(CC(C3)C1)C2
InChIKey
InChIKey=FFLMQMHVDRODBH-UHFFFAOYSA-N
Formula
C21H21F3O4
Mass
394.39
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Butyrophenones
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Butyrophenones
Intermediate Tree Nodes
Not available
Direct Parent
Butyrophenones
Alternative Parents
Benzodioxoles Aryl alkyl ketones Beta-diketones Alpha-haloketones Oxacyclic compounds Acetals Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Butyrophenone - Benzodioxole - Aryl ketone - Aryl alkyl ketone - 1,3-diketone - 1,3-dicarbonyl compound - Alpha-haloketone - Ketone - Organoheterocyclic compound - Oxacycle - Acetal - Organic oxide - Organooxygen compound - Organofluoride - Organohalogen compound - Carbonyl group - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Aldehyde - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as butyrophenones. These are compounds containing 1-phenylbutan-1-one moiety.
External Descriptors
Not available