Compound Identification
SMILES
CC1(CC1)C1=C(C=NO1)C(=O)C1=C(C=C(C=C1)C(F)(F)F)S(C)(=O)=O
InChIKey
InChIKey=HJBYIFZOKDDCDG-UHFFFAOYSA-N
Formula
C16H14F3NO4S
Mass
373.35
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 Aryl-phenylketones
-
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
Aryl-phenylketones
Alternative Parents
Trifluoromethylbenzenes Benzenesulfonyl compounds Benzoyl derivatives 5-cyclopropylisoxazoles Sulfones Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl-phenylketone - Trifluoromethylbenzene - Benzenesulfonyl group - Benzoyl - 5-cyclopropylisoxazole - Cyclopropylisoxazole - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Azole - Sulfonyl - Sulfone - Isoxazole - Oxacycle - Azacycle - Organoheterocyclic compound - Organic oxide - Organonitrogen compound - Organofluoride - Organohalogen compound - Organosulfur compound - Organic nitrogen compound - Alkyl fluoride - Alkyl halide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aryl-phenylketones. These are aromatic compounds containing a ketone substituted by one aryl group, and a phenyl group.
External Descriptors
Not available