trimethyl-[2-oxidanyl-3-[3-[2-oxidanyl-3-(trimethylazaniumyl)propoxy]phenoxy]propyl]azanium diiodide

Systemtic Name: trimethyl-[2-oxidanyl-3-[3-[2-oxidanyl-3-(trimethylazaniumyl)propoxy]phenoxy]propyl]azanium diiodide Openeye Name: [2-hydroxy-3-[3-[2-hydroxy-3-(trimethylammonio)propoxy]phenoxy]propyl]-trimethyl-ammonium diiodide CAS Name: [2-hydroxy-3-[3-[2-hydroxy-3-(trimethylammonio)propoxy]phenoxy]propyl]-trimethylammonium diiodide IUPAC Name: [2-hydroxy-3-[3-[2-hydroxy-3-(trimethylazaniumyl)propoxy]phenoxy]propyl]-trimethylazanium diiodide Traditional Name: [2-hydroxy-3-[3-[2-hydroxy-3-(trimethylammonio)propoxy]phenoxy]propyl]-trimethyl-ammonium diiodide Formula: C18H34I2N2O4 MolecularWeight: 596.2825

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(COC1=CC(=CC=C1)OCC(C[N+](C)(C)C)O)O.[I-].[I-]

Isomeric SMILES

C[N+](C)(C)CC(COC1=CC(=CC=C1)OCC(C[N+](C)(C)C)O)O.[I-].[I-]

InChI

InChI=1S/C18H34N2O4.2HI/c1-19(2,3)11-15(21)13-23-17-8-7-9-18(10-17)24-14-16(22)12-20(4,5)6;;/h7-10,15-16,21-22H,11-14H2,1-6H3;2*1H/q+2;;/p-2