tert-butyl 3-[[2-methoxy-5-(2-methyl-4-phenyl-but-3-yn-2-yl)phenyl]methylamino]-2-phenyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[2-methoxy-5-(2-methyl-4-phenyl-but-3-yn-2-yl)phenyl]methylamino]-2-phenyl-piperidine-1-carboxylate Openeye Name: tert-butyl 3-[[5-(1,1-dimethyl-3-phenyl-prop-2-ynyl)-2-methoxy-phenyl]methylamino]-2-phenyl-piperidine-1-carboxylate CAS Name: 3-[[2-methoxy-5-(2-methyl-4-phenylbut-3-yn-2-yl)phenyl]methylamino]-2-phenyl-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[2-methoxy-5-(2-methyl-4-phenylbut-3-yn-2-yl)phenyl]methylamino]-2-phenylpiperidine-1-carboxylate Traditional Name: 3-[[5-(1,1-dimethyl-3-phenyl-prop-2-ynyl)-2-methoxy-benzyl]amino]-2-phenyl-piperidine-1-carboxylic acid tert-butyl ester Formula: C35H42N2O3 MolecularWeight: 538.71958

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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(C)(C)C#CC4=CC=CC=C4)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1C2=CC=CC=C2)NCC3=C(C=CC(=C3)C(C)(C)C#CC4=CC=CC=C4)OC

InChI

InChI=1S/C35H42N2O3/c1-34(2,3)40-33(38)37-23-13-18-30(32(37)27-16-11-8-12-17-27)36-25-28-24-29(19-20-31(28)39-6)35(4,5)22-21-26-14-9-7-10-15-26/h7-12,14-17,19-20,24,30,32,36H,13,18,23,25H2,1-6H3