Compound Identification
SMILES
CN1[C@H](CCC2=CC=C(OS(=O)(=O)C3=CC=C(C)C=C3)C=C2)CCC[C@@H]1CC(=O)C1=CC=CC=C1
InChIKey
InChIKey=VTRNUBWSTNOOGD-IZZNHLLZSA-N
Formula
C29H33NO4S
Mass
491.65
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
p-Methylbenzenesulfonates Benzenesulfonate esters Tosyl compounds Alkaloids and derivatives Benzenesulfonyl compounds Arylsulfonic acids and derivatives Phenoxy compounds Benzoyl derivatives Aryl alkyl ketones Aralkylamines Piperidines Organosulfonic acid esters Beta-amino ketones Sulfonyls Trialkylamines Azacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Benzenesulfonate ester - P-methylbenzenesulfonate - Benzenesulfonate - Tosyl compound - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Alkaloid or derivatives - Phenoxy compound - Benzoyl - Aryl alkyl ketone - Toluene - Aralkylamine - Monocyclic benzene moiety - Beta-aminoketone - Piperidine - Organosulfonic acid ester - Benzenoid - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Azacycle - Organoheterocyclic compound - Amine - Organic nitrogen compound - Organosulfur compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - 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