2-(1-methylpiperidin-1-ium-1-yl)-1-[4-[3-(1-methylpiperidin-1-ium-1-yl)propanoyl]piperazin-1-yl]propan-1-one diiodide

Systemtic Name: 2-(1-methylpiperidin-1-ium-1-yl)-1-[4-[3-(1-methylpiperidin-1-ium-1-yl)propanoyl]piperazin-1-yl]propan-1-one diiodide Openeye Name: 2-(1-methylpiperidin-1-ium-1-yl)-1-[4-[3-(1-methylpiperidin-1-ium-1-yl)propanoyl]piperazin-1-yl]propan-1-one diiodide CAS Name: 2-(1-methyl-1-piperidin-1-iumyl)-1-[4-[3-(1-methyl-1-piperidin-1-iumyl)-1-oxopropyl]-1-piperazinyl]-1-propanone diiodide IUPAC Name: 2-(1-methylpiperidin-1-ium-1-yl)-1-[4-[3-(1-methylpiperidin-1-ium-1-yl)propanoyl]piperazin-1-yl]propan-1-one diiodide Traditional Name: 2-(1-methylpiperidin-1-ium-1-yl)-1-[4-[3-(1-methylpiperidin-1-ium-1-yl)propanoyl]piperazino]propan-1-one diiodide Formula: C22H42I2N4O2 MolecularWeight: 648.40342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C(=O)CC[N+]2(CCCCC2)C)[N+]3(CCCCC3)C.[I-].[I-]

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C(=O)CC[N+]2(CCCCC2)C)[N+]3(CCCCC3)C.[I-].[I-]

InChI

InChI=1S/C22H42N4O2.2HI/c1-20(26(3)17-8-5-9-18-26)22(28)24-13-11-23(12-14-24)21(27)10-19-25(2)15-6-4-7-16-25;;/h20H,4-19H2,1-3H3;2*1H/q+2;;/p-2