1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-3-(4-methoxyphenoxy)propan-2-ol dihydrochloride

Systemtic Name: 1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-3-(4-methoxyphenoxy)propan-2-ol dihydrochloride Openeye Name: 1-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-3-(4-methoxyphenoxy)propan-2-ol dihydrochloride CAS Name: 1-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-3-(4-methoxyphenoxy)-2-propanol dihydrochloride IUPAC Name: 1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-(4-methoxyphenoxy)propan-2-ol dihydrochloride Traditional Name: 1-[4-(5-chloro-2-methyl-phenyl)piperazino]-3-(4-methoxyphenoxy)propan-2-ol dihydrochloride Formula: C21H29Cl3N2O3 MolecularWeight: 463.82556

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)CC(COC3=CC=C(C=C3)OC)O.Cl.Cl

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)CC(COC3=CC=C(C=C3)OC)O.Cl.Cl

InChI

InChI=1S/C21H27ClN2O3.2ClH/c1-16-3-4-17(22)13-21(16)24-11-9-23(10-12-24)14-18(25)15-27-20-7-5-19(26-2)6-8-20;;/h3-8,13,18,25H,9-12,14-15H2,1-2H3;2*1H