Compound Identification
SMILES
OC(=O)C(O)=O.COC1=CC=C(C=C1)S(=O)(=O)N(CCN1CCC(CC1)C(=O)C1=CC=C(F)C=C1)C1=CC=CC=C1OC
InChIKey
InChIKey=DGFPRBOKCHBNTE-UHFFFAOYSA-N
Formula
C30H33FN2O9S
Mass
616.66
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 Sulfanilides Benzenesulfonyl compounds Methoxyanilines Benzoyl derivatives Aryl alkyl ketones Anisoles Phenoxy compounds Methoxybenzenes Fluorobenzenes Alkyl aryl ethers Piperidines Gamma-amino ketones Dicarboxylic acids and derivatives Aryl fluorides Organosulfonamides Aminosulfonyl compounds Trialkylamines Carboxylic acids Azacyclic compounds Hydrocarbon derivatives Organofluorides Organic oxides
Molecular Framework
Not available
Substituents
Alkyl-phenylketone - Benzenesulfonamide - Sulfanilide - Benzenesulfonyl group - Methoxyaniline - Phenoxy compound - Anisole - Benzoyl - Methoxybenzene - Aryl alkyl ketone - Phenol ether - Alkyl aryl ether - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Gamma-aminoketone - Benzenoid - Piperidine - Organosulfonic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Tertiary amine - Tertiary aliphatic amine - Azacycle - Carboxylic acid derivative - Carboxylic acid - Ether - Organoheterocyclic compound - Organosulfur compound - Organic nitrogen compound - Organic oxide - Amine - Organonitrogen compound - Hydrocarbon derivative - Organofluoride - Organohalogen 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