1-(1-methylpiperidin-1-ium-1-yl)-2-[4-[1-(1-methylpiperidin-1-ium-1-yl)-1-oxidanylidene-propan-2-yl]piperazin-1-yl]propan-1-one diiodide

Systemtic Name: 1-(1-methylpiperidin-1-ium-1-yl)-2-[4-[1-(1-methylpiperidin-1-ium-1-yl)-1-oxidanylidene-propan-2-yl]piperazin-1-yl]propan-1-one diiodide Openeye Name: 2-[4-[1-methyl-2-(1-methylpiperidin-1-ium-1-yl)-2-oxo-ethyl]piperazin-1-yl]-1-(1-methylpiperidin-1-ium-1-yl)propan-1-one diiodide CAS Name: 1-(1-methyl-1-piperidin-1-iumyl)-2-[4-[1-(1-methyl-1-piperidin-1-iumyl)-1-oxopropan-2-yl]-1-piperazinyl]-1-propanone diiodide IUPAC Name: 1-(1-methylpiperidin-1-ium-1-yl)-2-[4-[1-(1-methylpiperidin-1-ium-1-yl)-1-oxopropan-2-yl]piperazin-1-yl]propan-1-one diiodide Traditional Name: 2-[4-[2-keto-1-methyl-2-(1-methylpiperidin-1-ium-1-yl)ethyl]piperazino]-1-(1-methylpiperidin-1-ium-1-yl)propan-1-one diiodide Formula: C22H42I2N4O2 MolecularWeight: 648.40342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[N+]1(CCCCC1)C)N2CCN(CC2)C(C)C(=O)[N+]3(CCCCC3)C.[I-].[I-]

Isomeric SMILES

CC(C(=O)[N+]1(CCCCC1)C)N2CCN(CC2)C(C)C(=O)[N+]3(CCCCC3)C.[I-].[I-]

InChI

InChI=1S/C22H42N4O2.2HI/c1-19(21(27)25(3)15-7-5-8-16-25)23-11-13-24(14-12-23)20(2)22(28)26(4)17-9-6-10-18-26;;/h19-20H,5-18H2,1-4H3;2*1H/q+2;;/p-2