Compound Identification
SMILES
CC(C)C1=CC(C(=O)C[C@@]2(O)C(=O)N(C)C3=CC=CC=C23)=C(C)C=C1
InChIKey
InChIKey=ZRRFSBBGPRHVNK-NRFANRHFSA-N
Formula
C21H23NO3
Mass
337.419
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
-
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
Aromatic monoterpenoids Bicyclic monoterpenoids Phenylpropanes Cumenes Indoles and derivatives Aryl alkyl ketones Benzoyl derivatives Toluenes Beta-hydroxy ketones Tertiary carboxylic acid amides Tertiary alcohols Lactams Azacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - P-cymene - Aromatic monoterpenoid - Bicyclic monoterpenoid - Monoterpenoid - Cumene - Indole or derivatives - Phenylpropane - Benzoyl - Aryl alkyl ketone - Toluene - Monocyclic benzene moiety - Beta-hydroxy ketone - Benzenoid - Tertiary carboxylic acid amide - Tertiary alcohol - Lactam - Carboxamide group - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Alcohol - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - 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