Compound Identification
SMILES
COC1=CC=C(C=C1)S(=O)(=O)NNC(=O)C1=CNC(CC(=O)C2=CC=CC=C2)[C+]=C1
InChIKey
InChIKey=WMVZMOHQIXMNAI-UHFFFAOYSA-O
Formula
C21H20N3O5S
Mass
426.47
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
Benzenesulfonamides Benzenesulfonyl compounds Phenoxy compounds Methoxybenzenes Anisoles Aryl alkyl ketones Benzoyl derivatives Alkyl aryl ethers Dihydropyridines Sulfonohydrazides Hydrazinosulfonyl compounds Beta-amino ketones Vinylogous amides Amino acids and derivatives Allylamines Enamines Azacyclic compounds Dialkylamines Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Benzenesulfonamide - Benzenesulfonyl group - Phenoxy compound - Phenol ether - Anisole - Methoxybenzene - Benzoyl - Aryl alkyl ketone - Alkyl aryl ether - Dihydropyridine - Hydropyridine - Monocyclic benzene moiety - Sulfonohydrazide - Hydrazinosulfonyl compound - Beta-aminoketone - Benzenoid - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Vinylogous amide - Amino acid or derivatives - Allylamine - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Secondary aliphatic amine - Secondary amine - Enamine - Ether - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic oxide - Organosulfur compound - Organonitrogen compound - Organic cation - 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