1-(4-tert-butylcyclohexyl)oxy-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol dihydrochloride

Systemtic Name: 1-(4-tert-butylcyclohexyl)oxy-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol dihydrochloride Openeye Name: 1-(4-tert-butylcyclohexoxy)-3-[4-(2-pyridyl)piperazin-1-yl]propan-2-ol dihydrochloride CAS Name: 1-(4-tert-butylcyclohexyl)oxy-3-[4-(2-pyridinyl)-1-piperazinyl]-2-propanol dihydrochloride IUPAC Name: 1-(4-tert-butylcyclohexyl)oxy-3-(4-pyridin-2-ylpiperazin-1-yl)propan-2-ol dihydrochloride Traditional Name: 1-(4-tert-butylcyclohexoxy)-3-[4-(2-pyridyl)piperazino]propan-2-ol dihydrochloride Formula: C22H39Cl2N3O2 MolecularWeight: 448.46996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)OCC(CN2CCN(CC2)C3=CC=CC=N3)O.Cl.Cl

Isomeric SMILES

CC(C)(C)C1CCC(CC1)OCC(CN2CCN(CC2)C3=CC=CC=N3)O.Cl.Cl

InChI

InChI=1S/C22H37N3O2.2ClH/c1-22(2,3)18-7-9-20(10-8-18)27-17-19(26)16-24-12-14-25(15-13-24)21-6-4-5-11-23-21;;/h4-6,11,18-20,26H,7-10,12-17H2,1-3H3;2*1H