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

Systemtic Name: tert-butyl 3-[[2-methoxy-5-(2-methylpent-3-yn-2-yl)phenyl]methylamino]-2-phenyl-piperidine-1-carboxylate Openeye Name: tert-butyl 3-[[5-(1,1-dimethylbut-2-ynyl)-2-methoxy-phenyl]methylamino]-2-phenyl-piperidine-1-carboxylate CAS Name: 3-[[2-methoxy-5-(2-methylpent-3-yn-2-yl)phenyl]methylamino]-2-phenyl-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[2-methoxy-5-(2-methylpent-3-yn-2-yl)phenyl]methylamino]-2-phenylpiperidine-1-carboxylate Traditional Name: 3-[[5-(1,1-dimethylbut-2-ynyl)-2-methoxy-benzyl]amino]-2-phenyl-piperidine-1-carboxylic acid tert-butyl ester Formula: C30H40N2O3 MolecularWeight: 476.6502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC#CC(C)(C)C1=CC(=C(C=C1)OC)CNC2CCCN(C2C3=CC=CC=C3)C(=O)OC(C)(C)C

Isomeric SMILES

CC#CC(C)(C)C1=CC(=C(C=C1)OC)CNC2CCCN(C2C3=CC=CC=C3)C(=O)OC(C)(C)C

InChI

InChI=1S/C30H40N2O3/c1-8-18-30(5,6)24-16-17-26(34-7)23(20-24)21-31-25-15-12-19-32(28(33)35-29(2,3)4)27(25)22-13-10-9-11-14-22/h9-11,13-14,16-17,20,25,27,31H,12,15,19,21H2,1-7H3