1-(4-pyridin-2-ylpiperazin-1-yl)-3-(3,3,5-trimethylcyclohexyl)oxy-propan-2-ol dichloride

Systemtic Name: 1-(4-pyridin-2-ylpiperazin-1-yl)-3-(3,3,5-trimethylcyclohexyl)oxy-propan-2-ol dichloride Openeye Name: 1-[4-(2-pyridyl)piperazin-1-yl]-3-(3,3,5-trimethylcyclohexoxy)propan-2-ol dichloride CAS Name: 1-[4-(2-pyridinyl)-1-piperazinyl]-3-(3,3,5-trimethylcyclohexyl)oxy-2-propanol dichloride IUPAC Name: 1-(4-pyridin-2-ylpiperazin-1-yl)-3-(3,3,5-trimethylcyclohexyl)oxypropan-2-ol dichloride Traditional Name: 1-[4-(2-pyridyl)piperazino]-3-(3,3,5-trimethylcyclohexoxy)propan-2-ol dichloride Formula: C21H35Cl2N3O2-2 MolecularWeight: 432.4275

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(C)C)OCC(CN2CCN(CC2)C3=CC=CC=N3)O.[Cl-].[Cl-]

Isomeric SMILES

CC1CC(CC(C1)(C)C)OCC(CN2CCN(CC2)C3=CC=CC=N3)O.[Cl-].[Cl-]

InChI

InChI=1S/C21H35N3O2.2ClH/c1-17-12-19(14-21(2,3)13-17)26-16-18(25)15-23-8-10-24(11-9-23)20-6-4-5-7-22-20;;/h4-7,17-19,25H,8-16H2,1-3H3;2*1H/p-2