Compound Identification
SMILES
FC1=CC=C(C=C1)C(=O)C1C(C2=CC(F)=CC=C2)C(C#N)(C#N)C2N1C=CC1=CC=CC=C21
InChIKey
InChIKey=ZCQXDEVYYADLAT-UHFFFAOYSA-N
Formula
C27H17F2N3O
Mass
437.45
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
Phenylpyrrolidines Benzoyl derivatives Aryl alkyl ketones Fluorobenzenes Aralkylamines Aryl fluorides Pyrroles Alpha-amino ketones Trialkylamines Nitriles Enamines Azacyclic compounds Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - 3-phenylpyrrolidine - Benzoyl - Aryl alkyl ketone - Aralkylamine - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Alpha-aminoketone - Pyrrolidine - Pyrrole - Tertiary aliphatic amine - Tertiary amine - Azacycle - Enamine - Organoheterocyclic compound - Carbonitrile - Nitrile - Amine - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Cyanide - Organic oxide - Organohalogen compound - Organofluoride - Aromatic heteropolycyclic 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