2-[1-(1,1-dimethylpiperidin-1-ium-4-yl)-2-phenyl-ethoxy]ethyl-trimethyl-azanium diiodide

Systemtic Name: 2-[1-(1,1-dimethylpiperidin-1-ium-4-yl)-2-phenyl-ethoxy]ethyl-trimethyl-azanium diiodide Openeye Name: 2-[1-(1,1-dimethylpiperidin-1-ium-4-yl)-2-phenyl-ethoxy]ethyl-trimethyl-ammonium diiodide CAS Name: 2-[1-(1,1-dimethyl-4-piperidin-1-iumyl)-2-phenylethoxy]ethyl-trimethylammonium diiodide IUPAC Name: 2-[1-(1,1-dimethylpiperidin-1-ium-4-yl)-2-phenylethoxy]ethyl-trimethylazanium diiodide Traditional Name: 2-[1-(1,1-dimethylpiperidin-1-ium-4-yl)-2-phenyl-ethoxy]ethyl-trimethyl-ammonium diiodide Formula: C20H36I2N2O MolecularWeight: 574.32158

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(CC1)C(CC2=CC=CC=C2)OCC[N+](C)(C)C)C.[I-].[I-]

Isomeric SMILES

C[N+]1(CCC(CC1)C(CC2=CC=CC=C2)OCC[N+](C)(C)C)C.[I-].[I-]

InChI

InChI=1S/C20H36N2O.2HI/c1-21(2,3)15-16-23-20(17-18-9-7-6-8-10-18)19-11-13-22(4,5)14-12-19;;/h6-10,19-20H,11-17H2,1-5H3;2*1H/q+2;;/p-2