N-[3-(3-oxidanylidenebutyl)-5-(trifluoromethyl)phenyl]methanesulfonamide

Systemtic Name: N-[3-(3-oxidanylidenebutyl)-5-(trifluoromethyl)phenyl]methanesulfonamide Openeye Name: N-[3-(3-oxobutyl)-5-(trifluoromethyl)phenyl]methanesulfonamide CAS Name: N-[3-(3-oxobutyl)-5-(trifluoromethyl)phenyl]methanesulfonamide IUPAC Name: N-[3-(3-oxobutyl)-5-(trifluoromethyl)phenyl]methanesulfonamide Traditional Name: N-[3-(3-ketobutyl)-5-(trifluoromethyl)phenyl]methanesulfonamide Formula: C12H14F3NO3S MolecularWeight: 309.30467

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC1=CC(=CC(=C1)NS(=O)(=O)C)C(F)(F)F

Isomeric SMILES

CC(=O)CCC1=CC(=CC(=C1)NS(=O)(=O)C)C(F)(F)F

InChI

InChI=1S/C12H14F3NO3S/c1-8(17)3-4-9-5-10(12(13,14)15)7-11(6-9)16-20(2,18)19/h5-7,16H,3-4H2,1-2H3