Compound Identification
SMILES
OC(=O)CNN1CC2=CC=CC=C2C(CNC2CCCCC2)C1C(=O)C1=CC=CC=C1
InChIKey
InChIKey=ADSCPFIVNNJMDZ-UHFFFAOYSA-N
Formula
C25H31N3O3
Mass
421.541
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
Tetrahydroisoquinolines Alpha amino acids and derivatives Benzoyl derivatives Aryl alkyl ketones Cyclohexylamines Aralkylamines Gamma-amino ketones Amino acids Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Azacyclic compounds Alkylhydrazines Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Alpha-amino acid or derivatives - Tetrahydroisoquinoline - Benzoyl - Aryl alkyl ketone - Cyclohexylamine - Aralkylamine - Monocyclic benzene moiety - Gamma-aminoketone - Benzenoid - Amino acid or derivatives - Amino acid - Alkylhydrazine - Carboxylic acid derivative - Carboxylic acid - Azacycle - Secondary aliphatic amine - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Secondary amine - Organic oxide - Hydrocarbon derivative - Hydrazine derivative - Amine - Organonitrogen compound - 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