diethyl-methyl-[2-[1-(1-methylpyridin-1-ium-3-yl)-2-phenyl-ethoxy]ethyl]azanium diiodide

Systemtic Name: diethyl-methyl-[2-[1-(1-methylpyridin-1-ium-3-yl)-2-phenyl-ethoxy]ethyl]azanium diiodide Openeye Name: diethyl-methyl-[2-[1-(1-methylpyridin-1-ium-3-yl)-2-phenyl-ethoxy]ethyl]ammonium diiodide CAS Name: diethyl-methyl-[2-[1-(1-methyl-3-pyridin-1-iumyl)-2-phenylethoxy]ethyl]ammonium diiodide IUPAC Name: diethyl-methyl-[2-[1-(1-methylpyridin-1-ium-3-yl)-2-phenylethoxy]ethyl]azanium diiodide Traditional Name: diethyl-methyl-[2-[1-(1-methylpyridin-1-ium-3-yl)-2-phenyl-ethoxy]ethyl]ammonium diiodide Formula: C21H32I2N2O MolecularWeight: 582.30052

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CCOC(CC1=CC=CC=C1)C2=C[N+](=CC=C2)C.[I-].[I-]

Isomeric SMILES

CC[N+](C)(CC)CCOC(CC1=CC=CC=C1)C2=C[N+](=CC=C2)C.[I-].[I-]

InChI

InChI=1S/C21H32N2O.2HI/c1-5-23(4,6-2)15-16-24-21(17-19-11-8-7-9-12-19)20-13-10-14-22(3)18-20;;/h7-14,18,21H,5-6,15-17H2,1-4H3;2*1H/q+2;;/p-2