hexane-1-sulfonate; tetrahexylphosphanium; tetraoctylphosphanium

Systemtic Name: hexane-1-sulfonate; tetrahexylphosphanium; tetraoctylphosphanium Openeye Name: hexane-1-sulfonate; tetrahexylphosphonium; tetraoctylphosphonium CAS Name: 1-hexanesulfonate; tetrahexylphosphonium; tetraoctylphosphonium IUPAC Name: hexane-1-sulfonate; tetrahexylphosphanium; tetraoctylphosphanium Traditional Name: hexane-1-sulfonate; tetrahexylphosphonium; tetraoctylphosphonium Formula: C68H146O6P2S2 MolecularWeight: 1185.960762

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC[P+](CCCCCCCC)(CCCCCCCC)CCCCCCCC.CCCCCC[P+](CCCCCC)(CCCCCC)CCCCCC.CCCCCCS(=O)(=O)[O-].CCCCCCS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCC[P+](CCCCCCCC)(CCCCCCCC)CCCCCCCC.CCCCCC[P+](CCCCCC)(CCCCCC)CCCCCC.CCCCCCS(=O)(=O)[O-].CCCCCCS(=O)(=O)[O-]

InChI

InChI=1S/C32H68P.C24H52P.2C6H14O3S/c1-5-9-13-17-21-25-29-33(30-26-22-18-14-10-6-2,31-27-23-19-15-11-7-3)32-28-24-20-16-12-8-4;1-5-9-13-17-21-25(22-18-14-10-6-2,23-19-15-11-7-3)24-20-16-12-8-4;2*1-2-3-4-5-6-10(7,8)9/h5-32H2,1-4H3;5-24H2,1-4H3;2*2-6H2,1H3,(H,7,8,9)/q2*+1;;/p-2