Compound Identification
SMILES
CC(C)(N)CC1=CC=CC=C1.CCN(CC)C(C)C(=O)C1=CC=CC=C1.CN(C)CCCC1(OCC2=C1C=CC(=C2)C#N)C1=CC=C(F)C=C1
InChIKey
InChIKey=QKDBFPPZULACOL-UHFFFAOYSA-N
Formula
C43H55FN4O2
Mass
678.937
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
Phenylbutylamines Amphetamines and derivatives Phenylpropanes Isocoumarans Aryl alkyl ketones Benzoyl derivatives Aralkylamines Fluorobenzenes Aryl fluorides Alpha-amino ketones Trialkylamines Nitriles Dialkyl ethers Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Monoalkylamines
Molecular Framework
Not available
Substituents
Alkyl-phenylketone - Phenylbutylamine - Amphetamine or derivatives - Phenylpropane - Isocoumaran - Aryl alkyl ketone - Benzoyl - Aralkylamine - Halobenzene - Fluorobenzene - Benzenoid - Aryl fluoride - Monocyclic benzene moiety - Aryl halide - Alpha-aminoketone - Tertiary aliphatic amine - Tertiary amine - Oxacycle - Organoheterocyclic compound - Dialkyl ether - Ether - Carbonitrile - Nitrile - Primary amine - Cyanide - Amine - Organic nitrogen compound - Organonitrogen compound - Primary aliphatic amine - Organic oxide - Hydrocarbon derivative - 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