Compound Identification
SMILES
CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N1CCN(CC1)C1=CC=C(C=C1)C(C)=O
InChIKey
InChIKey=XCKIOCVTCBBIIE-UHFFFAOYSA-N
Formula
C21H24N2O5S
Mass
416.49
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
Phenylpiperazines N-arylpiperazines Benzenesulfonamides Benzoic acid esters Acetophenones Benzenesulfonyl compounds Aniline and substituted anilines Aryl alkyl ketones Benzoyl derivatives Dialkylarylamines Organosulfonamides Sulfonyls Carboxylic acid esters Amino acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alkyl-phenylketone - Phenylpiperazine - N-arylpiperazine - Benzoate ester - Benzenesulfonamide - Benzoic acid or derivatives - Acetophenone - Benzenesulfonyl group - Aniline or substituted anilines - Dialkylarylamine - Aryl alkyl ketone - Benzoyl - Tertiary aliphatic/aromatic amine - Piperazine - Benzenoid - Monocyclic benzene moiety - 1,4-diazinane - Organosulfonic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Carboxylic acid ester - Tertiary amine - Amino acid or derivatives - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Amine - 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