4-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecakis(fluoranyl)octylsulfonyl]-1,1-dihexyl-piperazin-1-ium iodide

Systemtic Name: 4-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecakis(fluoranyl)octylsulfonyl]-1,1-dihexyl-piperazin-1-ium iodide Openeye Name: 4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonyl)-1,1-dihexyl-piperazin-1-ium iodide CAS Name: 4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonyl)-1,1-dihexylpiperazin-1-ium iodide IUPAC Name: 4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonyl)-1,1-dihexylpiperazin-1-ium iodide Traditional Name: 4-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctylsulfonyl)-1,1-dihexyl-piperazin-1-ium iodide Formula: C24H34F17IN2O2S MolecularWeight: 864.481284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[N+]1(CCN(CC1)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CCCCCC.[I-]

Isomeric SMILES

CCCCCC[N+]1(CCN(CC1)S(=O)(=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CCCCCC.[I-]

InChI

InChI=1S/C24H34F17N2O2S.HI/c1-3-5-7-9-13-43(14-10-8-6-4-2)15-11-42(12-16-43)46(44,45)24(40,41)22(35,36)20(31,32)18(27,28)17(25,26)19(29,30)21(33,34)23(37,38)39;/h3-16H2,1-2H3;1H/q+1;/p-1