Compound Identification
SMILES
C[C@H](OC(=O)\C=C\C1=NC2=CC=CC=C2C=C1)C(=O)C1=CC=C(NS(C)(=O)=O)C=C1
InChIKey
InChIKey=FIJPMLRTZUORBX-BUYIWHAFSA-N
Formula
C22H20N2O5S
Mass
424.47
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
Sulfanilides Quinolines and derivatives Phenylpropanes Aryl alkyl ketones Benzoyl derivatives Alpha-acyloxy ketones Fatty acid esters Pyridines and derivatives Organosulfonamides Organic sulfonamides Heteroaromatic compounds Aminosulfonyl compounds Enoate esters Azacyclic compounds Monocarboxylic acids and derivatives Organonitrogen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Quinoline - Sulfanilide - Phenylpropane - Benzoyl - Aryl alkyl ketone - Fatty acid ester - Alpha-acyloxy ketone - Pyridine - Monocyclic benzene moiety - Organic sulfonic acid amide - Organosulfonic acid amide - Benzenoid - Fatty acyl - Sulfonyl - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Heteroaromatic compound - Organosulfonic acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organosulfur compound - 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