1-[4-(1-adamantyl)phenoxy]-3-(4-methylpiperazin-1-yl)propan-2-ol dihydrochloride

Systemtic Name: 1-[4-(1-adamantyl)phenoxy]-3-(4-methylpiperazin-1-yl)propan-2-ol dihydrochloride Openeye Name: 1-[4-(1-adamantyl)phenoxy]-3-(4-methylpiperazin-1-yl)propan-2-ol dihydrochloride CAS Name: 1-[4-(1-adamantyl)phenoxy]-3-(4-methyl-1-piperazinyl)-2-propanol dihydrochloride IUPAC Name: 1-[4-(1-adamantyl)phenoxy]-3-(4-methylpiperazin-1-yl)propan-2-ol dihydrochloride Traditional Name: 1-[4-(1-adamantyl)phenoxy]-3-(4-methylpiperazino)propan-2-ol dihydrochloride Formula: C24H38Cl2N2O2 MolecularWeight: 457.47672

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC(COC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)O.Cl.Cl

Isomeric SMILES

CN1CCN(CC1)CC(COC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)O.Cl.Cl

InChI

InChI=1S/C24H36N2O2.2ClH/c1-25-6-8-26(9-7-25)16-22(27)17-28-23-4-2-21(3-5-23)24-13-18-10-19(14-24)12-20(11-18)15-24;;/h2-5,18-20,22,27H,6-17H2,1H3;2*1H