4-[2-[(4-butoxyphenyl)-methyl-amino]ethyl]-1-(2-oxidanyl-2-phenyl-ethyl)piperidin-4-ol dihydrochloride

Systemtic Name: 4-[2-[(4-butoxyphenyl)-methyl-amino]ethyl]-1-(2-oxidanyl-2-phenyl-ethyl)piperidin-4-ol dihydrochloride Openeye Name: 4-[2-(4-butoxy-N-methyl-anilino)ethyl]-1-(2-hydroxy-2-phenyl-ethyl)piperidin-4-ol dihydrochloride CAS Name: 4-[2-(4-butoxy-N-methylanilino)ethyl]-1-(2-hydroxy-2-phenylethyl)-4-piperidinol dihydrochloride IUPAC Name: 4-[2-(4-butoxy-N-methylanilino)ethyl]-1-(2-hydroxy-2-phenylethyl)piperidin-4-ol dihydrochloride Traditional Name: 4-[2-(4-butoxy-N-methyl-anilino)ethyl]-1-(2-hydroxy-2-phenyl-ethyl)piperidin-4-ol dihydrochloride Formula: C26H40Cl2N2O3 MolecularWeight: 499.5134

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)N(C)CCC2(CCN(CC2)CC(C3=CC=CC=C3)O)O.Cl.Cl

Isomeric SMILES

CCCCOC1=CC=C(C=C1)N(C)CCC2(CCN(CC2)CC(C3=CC=CC=C3)O)O.Cl.Cl

InChI

InChI=1S/C26H38N2O3.2ClH/c1-3-4-20-31-24-12-10-23(11-13-24)27(2)17-14-26(30)15-18-28(19-16-26)21-25(29)22-8-6-5-7-9-22;;/h5-13,25,29-30H,3-4,14-21H2,1-2H3;2*1H