diethyl-methyl-[2-[2-[2-(1-methylpiperidin-1-ium-1-yl)-2-phenyl-ethanoyl]oxyethoxy]ethyl]azanium diiodide

Systemtic Name: diethyl-methyl-[2-[2-[2-(1-methylpiperidin-1-ium-1-yl)-2-phenyl-ethanoyl]oxyethoxy]ethyl]azanium diiodide Openeye Name: diethyl-methyl-[2-[2-[2-(1-methylpiperidin-1-ium-1-yl)-2-phenyl-acetyl]oxyethoxy]ethyl]ammonium diiodide CAS Name: diethyl-methyl-[2-[2-[2-(1-methyl-1-piperidin-1-iumyl)-1-oxo-2-phenylethoxy]ethoxy]ethyl]ammonium diiodide IUPAC Name: diethyl-methyl-[2-[2-[2-(1-methylpiperidin-1-ium-1-yl)-2-phenylacetyl]oxyethoxy]ethyl]azanium diiodide Traditional Name: diethyl-methyl-[2-[2-[2-(1-methylpiperidin-1-ium-1-yl)-2-phenyl-acetyl]oxyethoxy]ethyl]ammonium diiodide Formula: C23H40I2N2O3 MolecularWeight: 646.38424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CCOCCOC(=O)C(C1=CC=CC=C1)[N+]2(CCCCC2)C.[I-].[I-]

Isomeric SMILES

CC[N+](C)(CC)CCOCCOC(=O)C(C1=CC=CC=C1)[N+]2(CCCCC2)C.[I-].[I-]

InChI

InChI=1S/C23H40N2O3.2HI/c1-5-24(3,6-2)17-18-27-19-20-28-23(26)22(21-13-9-7-10-14-21)25(4)15-11-8-12-16-25;;/h7,9-10,13-14,22H,5-6,8,11-12,15-20H2,1-4H3;2*1H/q+2;;/p-2