1-(1-adamantyloxy)-3-[4-(2-fluorophenyl)piperazin-1-yl]propan-2-ol dihydrochloride

Systemtic Name: 1-(1-adamantyloxy)-3-[4-(2-fluorophenyl)piperazin-1-yl]propan-2-ol dihydrochloride Openeye Name: 1-(1-adamantyloxy)-3-[4-(2-fluorophenyl)piperazin-1-yl]propan-2-ol dihydrochloride CAS Name: 1-(1-adamantyloxy)-3-[4-(2-fluorophenyl)-1-piperazinyl]-2-propanol dihydrochloride IUPAC Name: 1-(1-adamantyloxy)-3-[4-(2-fluorophenyl)piperazin-1-yl]propan-2-ol dihydrochloride Traditional Name: 1-(1-adamantyloxy)-3-[4-(2-fluorophenyl)piperazino]propan-2-ol dihydrochloride Formula: C23H35Cl2FN2O2 MolecularWeight: 461.440603

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COC23CC4CC(C2)CC(C4)C3)O)C5=CC=CC=C5F.Cl.Cl

Isomeric SMILES

C1CN(CCN1CC(COC23CC4CC(C2)CC(C4)C3)O)C5=CC=CC=C5F.Cl.Cl

InChI

InChI=1S/C23H33FN2O2.2ClH/c24-21-3-1-2-4-22(21)26-7-5-25(6-8-26)15-20(27)16-28-23-12-17-9-18(13-23)11-19(10-17)14-23;;/h1-4,17-20,27H,5-16H2;2*1H