1-[2-(1-adamantyl)ethoxy]-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol dihydrochloride

Systemtic Name: 1-[2-(1-adamantyl)ethoxy]-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol dihydrochloride Openeye Name: 1-[2-(1-adamantyl)ethoxy]-3-[4-(2-pyridyl)piperazin-1-yl]propan-2-ol dihydrochloride CAS Name: 1-[2-(1-adamantyl)ethoxy]-3-[4-(2-pyridinyl)-1-piperazinyl]-2-propanol dihydrochloride IUPAC Name: 1-[2-(1-adamantyl)ethoxy]-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol dihydrochloride Traditional Name: 1-[2-(1-adamantyl)ethoxy]-3-[4-(2-pyridyl)piperazino]propan-2-ol dihydrochloride Formula: C24H39Cl2N3O2 MolecularWeight: 472.49136

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COCCC23CC4CC(C2)CC(C4)C3)O)C5=CC=CC=N5.Cl.Cl

Isomeric SMILES

C1CN(CCN1CC(COCCC23CC4CC(C2)CC(C4)C3)O)C5=CC=CC=N5.Cl.Cl

InChI

InChI=1S/C24H37N3O2.2ClH/c28-22(17-26-6-8-27(9-7-26)23-3-1-2-5-25-23)18-29-10-4-24-14-19-11-20(15-24)13-21(12-19)16-24;;/h1-3,5,19-22,28H,4,6-18H2;2*1H