Compound Identification
SMILES
CC(=O)C1=CC=C(C=C1)S(=O)(=O)NC1=C(C=C(Cl)C=C1)C(=O)C1=C[N+]([O-])=C(C)C=C1
InChIKey
InChIKey=SFQJLENSSRDSSZ-UHFFFAOYSA-N
Formula
C21H17ClN2O5S
Mass
444.89
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
Aryl-phenylketones Benzenesulfonamides Sulfanilides Benzenesulfonyl compounds Pyridinecarboxylic acids and derivatives Acetophenones Benzoyl derivatives Aryl alkyl ketones Chlorobenzenes Methylpyridines Pyridinium derivatives Organosulfonamides Aryl chlorides Aminosulfonyl compounds Heteroaromatic compounds Vinylogous amides Azacyclic compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Aryl-phenylketone - Sulfanilide - Benzenesulfonamide - Acetophenone - Benzenesulfonyl group - Pyridine carboxylic acid or derivatives - Aryl alkyl ketone - Benzoyl - Halobenzene - Methylpyridine - Chlorobenzene - Aryl chloride - Aryl halide - Pyridine - Pyridinium - Organosulfonic acid amide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Sulfonyl - Aminosulfonyl compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Vinylogous amide - Azacycle - Organoheterocyclic compound - Organohalogen compound - Organosulfur compound - Organic zwitterion - Organic salt - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organochloride - Organonitrogen 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