1-(4-tert-butylcyclohexyl)oxy-3-[4-(diphenylmethyl)piperazin-1-yl]propan-2-ol dihydrochloride

Systemtic Name: 1-(4-tert-butylcyclohexyl)oxy-3-[4-(diphenylmethyl)piperazin-1-yl]propan-2-ol dihydrochloride Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-3-(4-tert-butylcyclohexoxy)propan-2-ol dihydrochloride CAS Name: 1-(4-tert-butylcyclohexyl)oxy-3-[4-(diphenylmethyl)-1-piperazinyl]-2-propanol dihydrochloride IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-3-(4-tert-butylcyclohexyl)oxypropan-2-ol dihydrochloride Traditional Name: 1-(4-benzhydrylpiperazino)-3-(4-tert-butylcyclohexoxy)propan-2-ol dihydrochloride Formula: C30H46Cl2N2O2 MolecularWeight: 537.60444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)OCC(CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)O.Cl.Cl

Isomeric SMILES

CC(C)(C)C1CCC(CC1)OCC(CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)O.Cl.Cl

InChI

InChI=1S/C30H44N2O2.2ClH/c1-30(2,3)26-14-16-28(17-15-26)34-23-27(33)22-31-18-20-32(21-19-31)29(24-10-6-4-7-11-24)25-12-8-5-9-13-25;;/h4-13,26-29,33H,14-23H2,1-3H3;2*1H