Compound Identification
SMILES
OC1(CCN(CCCC(=O)C2=CC=C(NC3CCCCC3)C=C2)CC1)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=YJEBDQODOVSIPA-UHFFFAOYSA-N
Formula
C27H35ClN2O2
Mass
455.04
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 Butyrophenones Phenylbutylamines Aniline and substituted anilines Aryl alkyl ketones Benzoyl derivatives Phenylalkylamines Cyclohexylamines Chlorobenzenes Secondary alkylarylamines Gamma-amino ketones Aryl chlorides Tertiary alcohols Trialkylamines Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Phenylpiperidine - Butyrophenone - Phenylbutylamine - Benzoyl - Phenylalkylamine - Aniline or substituted anilines - Aryl alkyl ketone - Chlorobenzene - Cyclohexylamine - Halobenzene - Aralkylamine - Secondary aliphatic/aromatic amine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Gamma-aminoketone - Benzenoid - Piperidine - Tertiary alcohol - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Azacycle - Secondary amine - Organonitrogen compound - Organochloride - Organohalogen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Amine - 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