4-[4-(1,1-dimethylpiperidin-1-ium-4-yl)-1-methyl-piperidin-1-ium-1-yl]-1,1-diphenyl-butan-1-ol diiodide

Systemtic Name: 4-[4-(1,1-dimethylpiperidin-1-ium-4-yl)-1-methyl-piperidin-1-ium-1-yl]-1,1-diphenyl-butan-1-ol diiodide Openeye Name: 4-[4-(1,1-dimethylpiperidin-1-ium-4-yl)-1-methyl-piperidin-1-ium-1-yl]-1,1-diphenyl-butan-1-ol diiodide CAS Name: 4-[4-(1,1-dimethyl-4-piperidin-1-iumyl)-1-methyl-1-piperidin-1-iumyl]-1,1-diphenyl-1-butanol diiodide IUPAC Name: 4-[4-(1,1-dimethylpiperidin-1-ium-4-yl)-1-methylpiperidin-1-ium-1-yl]-1,1-diphenylbutan-1-ol diiodide Traditional Name: 4-[4-(1,1-dimethylpiperidin-1-ium-4-yl)-1-methyl-piperidin-1-ium-1-yl]-1,1-diphenyl-butan-1-ol diiodide Formula: C29H44I2N2O MolecularWeight: 690.4814

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCC(CC1)C2CC[N+](CC2)(C)CCCC(C3=CC=CC=C3)(C4=CC=CC=C4)O)C.[I-].[I-]

Isomeric SMILES

C[N+]1(CCC(CC1)C2CC[N+](CC2)(C)CCCC(C3=CC=CC=C3)(C4=CC=CC=C4)O)C.[I-].[I-]

InChI

InChI=1S/C29H44N2O.2HI/c1-30(2)21-15-25(16-22-30)26-17-23-31(3,24-18-26)20-10-19-29(32,27-11-6-4-7-12-27)28-13-8-5-9-14-28;;/h4-9,11-14,25-26,32H,10,15-24H2,1-3H3;2*1H/q+2;;/p-2