rel-(1R,4S)-N-[3,5-Bis(trifluoromethyl)phenyl]-7,7-dimethyl-2-oxobicyclo[2.2.1]heptane-1-methanesulfonamide

CAS Registry Number®

1274892-50-0
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CAS Name

rel-(1R,4S)-N-[3,5-Bis(trifluoromethyl)phenyl]-7,7-dimethyl-2-oxobicyclo[2.2.1]heptane-1-methanesulfonamide

Molecular Formula

C18H19F6NO3S

Molecular Mass

443.40

Cite this Page

rel-(1R,4S)-N-[3,5-Bis(trifluoromethyl)phenyl]-7,7-dimethyl-2-oxobicyclo[2.2.1]heptane-1-methanesulfonamide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1274892-50-0 (retrieved 2024-08-05) (CAS RN: 1274892-50-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1/C18H19F6NO3S/c1-15(2)10-3-4-16(15,14(26)8-10)9-29(27,28)25-13-6-11(17(19,20)21)5-12(7-13)18(22,23)24/h5-7,10,25H,3-4,8-9H2,1-2H3/t10-,16-/s2

InChIKey

InChIKey=QJPMWAHYGNAAAD-UFUVGVDJNA-N

SMILES

C(S(NC1=CC(C(F)(F)F)=CC(C(F)(F)F)=C1)(=O)=O)[C@@]23C(C)(C)[C@@](CC2=O)(CC3)[H]

Canonical SMILES

O=C1CC2CCC1(CS(=O)(=O)NC=3C=C(C=C(C3)C(F)(F)F)C(F)(F)F)C2(C)C

Other Names for this Substance

  • Bicyclo[2.2.1]heptane-1-methanesulfonamide, N-[3,5-bis(trifluoromethyl)phenyl]-7,7-dimethyl-2-oxo-, (1R,4S)-rel-
  • rel-(1R,4S)-N-[3,5-Bis(trifluoromethyl)phenyl]-7,7-dimethyl-2-oxobicyclo[2.2.1]heptane-1-methanesulfonamide