tert-butyl (2S,3S)-3-[[2-methoxy-5-(trifluoromethyloxy)phenyl]methylamino]-2-phenyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl (2S,3S)-3-[[2-methoxy-5-(trifluoromethyloxy)phenyl]methylamino]-2-phenyl-piperidine-1-carboxylate Openeye Name: tert-butyl (2S,3S)-3-[[2-methoxy-5-(trifluoromethoxy)phenyl]methylamino]-2-phenyl-piperidine-1-carboxylate CAS Name: (2S,3S)-3-[[2-methoxy-5-(trifluoromethoxy)phenyl]methylamino]-2-phenyl-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S,3S)-3-[[2-methoxy-5-(trifluoromethoxy)phenyl]methylamino]-2-phenylpiperidine-1-carboxylate Traditional Name: (2S,3S)-3-[[2-methoxy-5-(trifluoromethoxy)benzyl]amino]-2-phenyl-piperidine-1-carboxylic acid tert-butyl ester Formula: C25H31F3N2O4 MolecularWeight: 480.51985

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1C2=CC=CC=C2)NCC3=C(C=CC(=C3)OC(F)(F)F)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC[C@@H]([C@@H]1C2=CC=CC=C2)NCC3=C(C=CC(=C3)OC(F)(F)F)OC

InChI

InChI=1S/C25H31F3N2O4/c1-24(2,3)34-23(31)30-14-8-11-20(22(30)17-9-6-5-7-10-17)29-16-18-15-19(33-25(26,27)28)12-13-21(18)32-4/h5-7,9-10,12-13,15,20,22,29H,8,11,14,16H2,1-4H3/t20-,22-/m0/s1