[(3S,4R)-4-[2,4-bis(fluoranyl)phenyl]-1-tert-butyl-pyrrolidin-3-yl]-[(2S,3R,4S)-3-(4-fluorophenyl)-2,4-dimethyl-3-oxidanyl-piperidin-1-yl]methanone

Systemtic Name: [(3S,4R)-4-[2,4-bis(fluoranyl)phenyl]-1-tert-butyl-pyrrolidin-3-yl]-[(2S,3R,4S)-3-(4-fluorophenyl)-2,4-dimethyl-3-oxidanyl-piperidin-1-yl]methanone Openeye Name: [(3S,4R)-1-tert-butyl-4-(2,4-difluorophenyl)pyrrolidin-3-yl]-[(2S,3R,4S)-3-(4-fluorophenyl)-3-hydroxy-2,4-dimethyl-1-piperidyl]methanone CAS Name: [(3S,4R)-1-tert-butyl-4-(2,4-difluorophenyl)-3-pyrrolidinyl]-[(2S,3R,4S)-3-(4-fluorophenyl)-3-hydroxy-2,4-dimethyl-1-piperidinyl]methanone IUPAC Name: [(3S,4R)-1-tert-butyl-4-(2,4-difluorophenyl)pyrrolidin-3-yl]-[(2S,3R,4S)-3-(4-fluorophenyl)-3-hydroxy-2,4-dimethylpiperidin-1-yl]methanone Traditional Name: [(3S,4R)-1-tert-butyl-4-(2,4-difluorophenyl)pyrrolidin-3-yl]-[(2S,3R,4S)-3-(4-fluorophenyl)-3-hydroxy-2,4-dimethyl-piperidino]methanone Formula: C28H35F3N2O2 MolecularWeight: 488.58491

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C(C1(C2=CC=C(C=C2)F)O)C)C(=O)C3CN(CC3C4=C(C=C(C=C4)F)F)C(C)(C)C

Isomeric SMILES

C[C@H]1CCN([C@H]([C@@]1(C2=CC=C(C=C2)F)O)C)C(=O)[C@@H]3CN(C[C@H]3C4=C(C=C(C=C4)F)F)C(C)(C)C

InChI

InChI=1S/C28H35F3N2O2/c1-17-12-13-33(18(2)28(17,35)19-6-8-20(29)9-7-19)26(34)24-16-32(27(3,4)5)15-23(24)22-11-10-21(30)14-25(22)31/h6-11,14,17-18,23-24,35H,12-13,15-16H2,1-5H3/t17-,18-,23-,24+,28-/m0/s1