Compound Identification
SMILES
[Cl-].FC1=CC=C(C=C1)C(=O)CCCN1CCN(CC1)C1=CC=CC2=C1OC=C2
InChIKey
InChIKey=XCQYMLNLHMTUBD-UHFFFAOYSA-M
Formula
C22H23ClFN2O2
Mass
401.89
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
N-arylpiperazines Phenylbutylamines Butyrophenones Benzofurans Aryl alkyl ketones Benzoyl derivatives Dialkylarylamines N-alkylpiperazines Fluorobenzenes Aryl fluorides Gamma-amino ketones Furans Heteroaromatic compounds Trialkylamines Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Organic chloride salts Organic oxides Organofluorides Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - N-arylpiperazine - Butyrophenone - Phenylbutylamine - Benzofuran - Benzoyl - Dialkylarylamine - Aryl alkyl ketone - Fluorobenzene - Halobenzene - N-alkylpiperazine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - Gamma-aminoketone - Piperazine - Benzenoid - Heteroaromatic compound - Furan - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Azacycle - Oxacycle - Organofluoride - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organic chloride salt - Organohalogen compound - Amine - Organic oxide - Organic anion - 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