Compound Identification
SMILES
O=C(C1CCN(CC1)C1CCCCC1)C1=CC=C(C=C1)S(=O)C1=CC2=C(OCO2)C=C1
InChIKey
InChIKey=FRUSDNNRKUTOBR-UHFFFAOYSA-N
Formula
C25H29NO4S
Mass
439.57
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
Benzodioxoles Phenyl sulfoxides Benzoyl derivatives Aryl alkyl ketones Cyclohexylamines Piperidines Gamma-amino ketones Sulfoxides Trialkylamines Sulfinyl compounds Oxacyclic compounds Acetals Azacyclic compounds Aldehydes Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Phenyl sulfoxide - Benzodioxole - Benzoyl - Aryl alkyl ketone - Cyclohexylamine - Monocyclic benzene moiety - Gamma-aminoketone - Piperidine - Benzenoid - Sulfoxide - Tertiary amine - Tertiary aliphatic amine - Acetal - Azacycle - Oxacycle - Sulfinyl compound - Organoheterocyclic compound - Aldehyde - Organosulfur compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Amine - 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