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

Systemtic Name: tert-butyl 3-[[2-methoxy-5-(2-methylbut-3-yn-2-yl)phenyl]methylamino]-2-phenyl-piperidine-1-carboxylate Openeye Name: tert-butyl 3-[[5-(1,1-dimethylprop-2-ynyl)-2-methoxy-phenyl]methylamino]-2-phenyl-piperidine-1-carboxylate CAS Name: 3-[[2-methoxy-5-(2-methylbut-3-yn-2-yl)phenyl]methylamino]-2-phenyl-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[2-methoxy-5-(2-methylbut-3-yn-2-yl)phenyl]methylamino]-2-phenylpiperidine-1-carboxylate Traditional Name: 3-[[5-(1,1-dimethylprop-2-ynyl)-2-methoxy-benzyl]amino]-2-phenyl-piperidine-1-carboxylic acid tert-butyl ester Formula: C29H38N2O3 MolecularWeight: 462.62362

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)C(C)(C)C#C)OC

Isomeric SMILES

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

InChI

InChI=1S/C29H38N2O3/c1-8-29(5,6)23-16-17-25(33-7)22(19-23)20-30-24-15-12-18-31(27(32)34-28(2,3)4)26(24)21-13-10-9-11-14-21/h1,9-11,13-14,16-17,19,24,26,30H,12,15,18,20H2,2-7H3