Compound Identification
SMILES
CC(=O)C1=CC=C(C=C1)C1=CC(NS(=O)(=O)C2=CC=C(C)C=C2)=C(S1)C(O)=O
InChIKey
InChIKey=XYFZUGCUFUXXGU-UHFFFAOYSA-N
Formula
C20H17NO5S2
Mass
415.48
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-toluenesulfonamides Benzenesulfonamides Acetophenones Benzenesulfonyl compounds 2,3,5-trisubstituted thiophenes Thiophene carboxylic acids Aryl alkyl ketones Benzoyl derivatives Organosulfonamides Heteroaromatic compounds Aminosulfonyl compounds Vinylogous amides Carboxylic acids Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - P-toluenesulfonamide - Benzenesulfonamide - Tosyl compound - Acetophenone - Benzenesulfonyl group - Benzoyl - Thiophene carboxylic acid - Aryl alkyl ketone - 2,3,5-trisubstituted thiophene - Thiophene carboxylic acid or derivatives - Toluene - Monocyclic benzene moiety - Organosulfonic acid amide - Benzenoid - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Vinylogous amide - Aminosulfonyl compound - Thiophene - Organoheterocyclic compound - Carboxylic acid derivative - Carboxylic acid - Organosulfur compound - Organonitrogen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - 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