tert-butyl 3-[[2-cyclopropyloxy-5-(trifluoromethyl)phenyl]methylamino]-2-phenyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[2-cyclopropyloxy-5-(trifluoromethyl)phenyl]methylamino]-2-phenyl-piperidine-1-carboxylate Openeye Name: tert-butyl 3-[[2-(cyclopropoxy)-5-(trifluoromethyl)phenyl]methylamino]-2-phenyl-piperidine-1-carboxylate CAS Name: 3-[[2-cyclopropyloxy-5-(trifluoromethyl)phenyl]methylamino]-2-phenyl-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[2-cyclopropyloxy-5-(trifluoromethyl)phenyl]methylamino]-2-phenylpiperidine-1-carboxylate Traditional Name: 3-[[2-(cyclopropoxy)-5-(trifluoromethyl)benzyl]amino]-2-phenyl-piperidine-1-carboxylic acid tert-butyl ester Formula: C27H33F3N2O3 MolecularWeight: 490.55773

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1C2=CC=CC=C2)NCC3=C(C=CC(=C3)C(F)(F)F)OC4CC4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1C2=CC=CC=C2)NCC3=C(C=CC(=C3)C(F)(F)F)OC4CC4

InChI

InChI=1S/C27H33F3N2O3/c1-26(2,3)35-25(33)32-15-7-10-22(24(32)18-8-5-4-6-9-18)31-17-19-16-20(27(28,29)30)11-14-23(19)34-21-12-13-21/h4-6,8-9,11,14,16,21-22,24,31H,7,10,12-13,15,17H2,1-3H3