3-(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: 3-(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: 3-(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: 3-(1-methyl-1-piperidin-1-iumyl)-1-[4-[3-(1-methyl-1-piperidin-1-iumyl)-1-oxopropyl]-1-piperazinyl]-1-propanone diiodide IUPAC Name: 3-(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: 3-(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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H42N4O2.2HI/c1-25(15-5-3-6-16-25)19-9-21(27)23-11-13-24(14-12-23)22(28)10-20-26(2)17-7-4-8-18-26;;/h3-20H2,1-2H3;2*1H/q+2;;/p-2