1-(4-chloranyl-2-methyl-phenoxy)-3-[4-(diphenylmethyl)piperazin-1-yl]propan-2-ol dihydrochloride

Systemtic Name: 1-(4-chloranyl-2-methyl-phenoxy)-3-[4-(diphenylmethyl)piperazin-1-yl]propan-2-ol dihydrochloride Openeye Name: 1-(4-benzhydrylpiperazin-1-yl)-3-(4-chloro-2-methyl-phenoxy)propan-2-ol dihydrochloride CAS Name: 1-(4-chloro-2-methylphenoxy)-3-[4-(diphenylmethyl)-1-piperazinyl]-2-propanol dihydrochloride IUPAC Name: 1-(4-benzhydrylpiperazin-1-yl)-3-(4-chloro-2-methylphenoxy)propan-2-ol dihydrochloride Traditional Name: 1-(4-benzhydrylpiperazino)-3-(4-chloro-2-methyl-phenoxy)propan-2-ol dihydrochloride Formula: C27H33Cl3N2O2 MolecularWeight: 523.92212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCC(CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)O.Cl.Cl

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCC(CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)O.Cl.Cl

InChI

InChI=1S/C27H31ClN2O2.2ClH/c1-21-18-24(28)12-13-26(21)32-20-25(31)19-29-14-16-30(17-15-29)27(22-8-4-2-5-9-22)23-10-6-3-7-11-23;;/h2-13,18,25,27,31H,14-17,19-20H2,1H3;2*1H