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

Systemtic Name: 1-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-3-propan-2-yloxy-propan-2-ol dihydrochloride Openeye Name: 1-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-3-isopropoxy-propan-2-ol dihydrochloride CAS Name: 1-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-3-propan-2-yloxy-2-propanol dihydrochloride IUPAC Name: 1-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-3-propan-2-yloxypropan-2-ol dihydrochloride Traditional Name: 1-[4-(5-chloro-2-methyl-phenyl)piperazino]-3-isopropoxy-propan-2-ol dihydrochloride Formula: C17H29Cl3N2O2 MolecularWeight: 399.78336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)CC(COC(C)C)O.Cl.Cl

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)CC(COC(C)C)O.Cl.Cl

InChI

InChI=1S/C17H27ClN2O2.2ClH/c1-13(2)22-12-16(21)11-19-6-8-20(9-7-19)17-10-15(18)5-4-14(17)3;;/h4-5,10,13,16,21H,6-9,11-12H2,1-3H3;2*1H