bis[1-(1-methylpiperidin-1-ium-1-yl)propan-2-yl] hexanedioate diiodide

Systemtic Name: bis[1-(1-methylpiperidin-1-ium-1-yl)propan-2-yl] hexanedioate diiodide Openeye Name: bis[1-methyl-2-(1-methylpiperidin-1-ium-1-yl)ethyl] hexanedioate diiodide CAS Name: hexanedioic acid bis[1-(1-methyl-1-piperidin-1-iumyl)propan-2-yl] ester diiodide IUPAC Name: bis[1-(1-methylpiperidin-1-ium-1-yl)propan-2-yl] hexanedioate diiodide Traditional Name: adipic acid bis[1-methyl-2-(1-methylpiperidin-1-ium-1-yl)ethyl] ester diiodide Formula: C24H46I2N2O4 MolecularWeight: 680.44198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[N+]1(CCCCC1)C)OC(=O)CCCCC(=O)OC(C)C[N+]2(CCCCC2)C.[I-].[I-]

Isomeric SMILES

CC(C[N+]1(CCCCC1)C)OC(=O)CCCCC(=O)OC(C)C[N+]2(CCCCC2)C.[I-].[I-]

InChI

InChI=1S/C24H46N2O4.2HI/c1-21(19-25(3)15-9-5-10-16-25)29-23(27)13-7-8-14-24(28)30-22(2)20-26(4)17-11-6-12-18-26;;/h21-22H,5-20H2,1-4H3;2*1H/q+2;;/p-2