Compound Identification
SMILES
OC1(CCN(CCCC(=O)C2=CC=C(F)C=C2)CC1)C1=CC=C([122I])C=C1
InChIKey
InChIKey=JPEHWRTVXAFUAU-GBNGAQPWSA-N
Formula
C21H23FINO2
Mass
462.326
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
Phenylpiperidines Phenylbutylamines Butyrophenones Benzoyl derivatives Aryl alkyl ketones Iodobenzenes Fluorobenzenes Aralkylamines Gamma-amino ketones Aryl iodides Aryl fluorides Tertiary alcohols Trialkylamines Azacyclic compounds Organopnictogen compounds Organoiodides Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Phenylpiperidine - Phenylbutylamine - Butyrophenone - Aryl alkyl ketone - Benzoyl - Aralkylamine - Iodobenzene - Halobenzene - Fluorobenzene - Benzenoid - Piperidine - Gamma-aminoketone - Monocyclic benzene moiety - Aryl iodide - Aryl halide - Aryl fluoride - Tertiary alcohol - Tertiary aliphatic amine - Tertiary amine - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organoiodide - Organofluoride - Organohalogen compound - Amine - Alcohol - 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