Compound Identification
SMILES
Cl.CCCCCCCCCCCCCCC(CCCCCN1CCC(CC1)C(=O)C1=CC=C(F)C=C1)(C#N)C1=CC(OC)=C(OC)C=C1
InChIKey
InChIKey=YKXQVLUHYHMPIX-UHFFFAOYSA-N
Formula
C41H62ClFN2O3
Mass
685.41
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
Dimethoxybenzenes Anisoles Phenoxy compounds Aryl alkyl ketones Benzoyl derivatives Alkyl aryl ethers Aralkylamines Fluorobenzenes Piperidines Aryl fluorides Gamma-amino ketones Trialkylamines Nitriles Azacyclic compounds Organic oxides Hydrochlorides Hydrocarbon derivatives Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Dimethoxybenzene - O-dimethoxybenzene - Anisole - Phenoxy compound - Benzoyl - Phenol ether - Aryl alkyl ketone - Methoxybenzene - Alkyl aryl ether - Fluorobenzene - Halobenzene - Aralkylamine - Benzenoid - Piperidine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Gamma-aminoketone - Tertiary aliphatic amine - Tertiary amine - Azacycle - Organoheterocyclic compound - Nitrile - Carbonitrile - Ether - Hydrocarbon derivative - Amine - Organic nitrogen compound - Cyanide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organic oxide - Hydrochloride - 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