Compound Identification
SMILES
O=C(CCC(=O)C1=CC=CC=C1)OCC1=CC(=CC=C1)S(=O)(=O)N1CCOCC1
InChIKey
InChIKey=OHFCDSKFDCHDJQ-UHFFFAOYSA-N
Formula
C21H23NO6S
Mass
417.48
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
Butyrophenones Benzenesulfonamides Benzyloxycarbonyls Benzenesulfonyl compounds Aryl alkyl ketones Benzoyl derivatives Gamma-keto acids and derivatives Fatty acid esters Morpholines Organosulfonamides Sulfonyls Carboxylic acid esters Monocarboxylic acids and derivatives Dialkyl ethers Oxacyclic compounds Azacyclic compounds Organic oxides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Butyrophenone - Benzenesulfonamide - Benzyloxycarbonyl - Benzenesulfonyl group - Gamma-keto acid - Aryl alkyl ketone - Benzoyl - Fatty acid ester - Morpholine - Benzenoid - Organosulfonic acid amide - Oxazinane - Fatty acyl - Monocyclic benzene moiety - Keto acid - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Carboxylic acid ester - Oxacycle - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic nitrogen compound - Organosulfur compound - Organonitrogen compound - 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