N-[[2-methoxy-5-(2-methylpent-3-yn-2-yl)phenyl]methyl]-2-phenyl-piperidin-3-amine dihydrochloride

Systemtic Name: N-[[2-methoxy-5-(2-methylpent-3-yn-2-yl)phenyl]methyl]-2-phenyl-piperidin-3-amine dihydrochloride Openeye Name: N-[[5-(1,1-dimethylbut-2-ynyl)-2-methoxy-phenyl]methyl]-2-phenyl-piperidin-3-amine dihydrochloride CAS Name: N-[[2-methoxy-5-(2-methylpent-3-yn-2-yl)phenyl]methyl]-2-phenyl-3-piperidinamine dihydrochloride IUPAC Name: N-[[2-methoxy-5-(2-methylpent-3-yn-2-yl)phenyl]methyl]-2-phenylpiperidin-3-amine dihydrochloride Traditional Name: [5-(1,1-dimethylbut-2-ynyl)-2-methoxy-benzyl]-(2-phenyl-3-piperidyl)amine dihydrochloride Formula: C25H34Cl2N2O MolecularWeight: 449.45626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC#CC(C)(C)C1=CC(=C(C=C1)OC)CNC2CCCNC2C3=CC=CC=C3.Cl.Cl

Isomeric SMILES

CC#CC(C)(C)C1=CC(=C(C=C1)OC)CNC2CCCNC2C3=CC=CC=C3.Cl.Cl

InChI

InChI=1S/C25H32N2O.2ClH/c1-5-15-25(2,3)21-13-14-23(28-4)20(17-21)18-27-22-12-9-16-26-24(22)19-10-7-6-8-11-19;;/h6-8,10-11,13-14,17,22,24,26-27H,9,12,16,18H2,1-4H3;2*1H