Compound Identification
SMILES
CC#CC1=C(C)C(C(C)=O)=C(C=C1C1CN2CCC1CC2CO)C1=CC=CC=C1
InChIKey
InChIKey=VPDMCVPBVRPRNN-UHFFFAOYSA-N
Formula
C26H29NO2
Mass
387.523
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
Phenylpiperidines Biphenyls and derivatives Acetophenones Quinuclidines Benzoyl derivatives Aryl alkyl ketones Toluenes Aralkylamines Trialkylamines 1,2-aminoalcohols Azacyclic compounds Primary alcohols Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Biphenyl - Phenylpiperidine - Acetophenone - Benzoyl - Quinuclidine - Aryl alkyl ketone - Toluene - Aralkylamine - Benzenoid - Piperidine - Monocyclic benzene moiety - Tertiary aliphatic amine - 1,2-aminoalcohol - Tertiary amine - Azacycle - Organoheterocyclic compound - Primary alcohol - Organonitrogen compound - Organic oxide - Organopnictogen compound - Hydrocarbon derivative - Amine - Alcohol - Organic nitrogen compound - 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