5-[3-(3-acetyloxy-1-methyl-piperidin-1-ium-1-yl)propanoyloxy]pentyl 3-(3-acetyloxy-1-methyl-piperidin-1-ium-1-yl)propanoate diiodide

Systemtic Name: 5-[3-(3-acetyloxy-1-methyl-piperidin-1-ium-1-yl)propanoyloxy]pentyl 3-(3-acetyloxy-1-methyl-piperidin-1-ium-1-yl)propanoate diiodide Openeye Name: 5-[3-(3-acetoxy-1-methyl-piperidin-1-ium-1-yl)propanoyloxy]pentyl 3-(3-acetoxy-1-methyl-piperidin-1-ium-1-yl)propanoate diiodide CAS Name: 3-(3-acetyloxy-1-methyl-1-piperidin-1-iumyl)propanoic acid 5-[3-(3-acetyloxy-1-methyl-1-piperidin-1-iumyl)-1-oxopropoxy]pentyl ester diiodide IUPAC Name: 5-[3-(3-acetyloxy-1-methylpiperidin-1-ium-1-yl)propanoyloxy]pentyl 3-(3-acetyloxy-1-methylpiperidin-1-ium-1-yl)propanoate diiodide Traditional Name: 3-(3-acetoxy-1-methyl-piperidin-1-ium-1-yl)propionic acid 5-[3-(3-acetoxy-1-methyl-piperidin-1-ium-1-yl)propanoyloxy]pentyl ester diiodide Formula: C27H48I2N2O8 MolecularWeight: 782.48756

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CCC[N+](C1)(C)CCC(=O)OCCCCCOC(=O)CC[N+]2(CCCC(C2)OC(=O)C)C.[I-].[I-]

Isomeric SMILES

CC(=O)OC1CCC[N+](C1)(C)CCC(=O)OCCCCCOC(=O)CC[N+]2(CCCC(C2)OC(=O)C)C.[I-].[I-]

InChI

InChI=1S/C27H48N2O8.2HI/c1-22(30)36-24-10-8-14-28(3,20-24)16-12-26(32)34-18-6-5-7-19-35-27(33)13-17-29(4)15-9-11-25(21-29)37-23(2)31;;/h24-25H,5-21H2,1-4H3;2*1H/q+2;;/p-2