(2S)-1-(4-tert-butylcyclohexyl)oxy-3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]propan-2-ol

Systemtic Name: (2S)-1-(4-tert-butylcyclohexyl)oxy-3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]propan-2-ol Openeye Name: (2S)-1-(4-tert-butylcyclohexoxy)-3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]propan-2-ol CAS Name: (2S)-1-(4-tert-butylcyclohexyl)oxy-3-[4-(2-hydroxyethyl)-1-piperazine-1,4-diiumyl]-2-propanol IUPAC Name: (2S)-1-(4-tert-butylcyclohexyl)oxy-3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]propan-2-ol Traditional Name: (2S)-1-(4-tert-butylcyclohexoxy)-3-[4-(2-hydroxyethyl)piperazine-1,4-diium-1-yl]propan-2-ol Formula: C19H40N2O3+2 MolecularWeight: 344.5325

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)OCC(C[NH+]2CC[NH+](CC2)CCO)O

Isomeric SMILES

CC(C)(C)C1CCC(CC1)OC[C@H](C[NH+]2CC[NH+](CC2)CCO)O

InChI

InChI=1S/C19H38N2O3/c1-19(2,3)16-4-6-18(7-5-16)24-15-17(23)14-21-10-8-20(9-11-21)12-13-22/h16-18,22-23H,4-15H2,1-3H3/p+2/t16?,17-,18?/m0/s1