butane; tributyl(phosphonomethyl)phosphanium; tris(fluoranyl)methanesulfonate

Systemtic Name: butane; tributyl(phosphonomethyl)phosphanium; tris(fluoranyl)methanesulfonate Openeye Name: butane; tributyl(phosphonomethyl)phosphonium; trifluoromethanesulfonate CAS Name: butane; tributyl(phosphonomethyl)phosphonium; trifluoromethanesulfonate IUPAC Name: butane; tributyl(phosphonomethyl)phosphanium; trifluoromethanesulfonate Traditional Name: n-butane; tributyl(phosphonomethyl)phosphonium; triflate Formula: C18H41F3O6P2S MolecularWeight: 504.522272

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Descriptors Computed from Structure

Canonical SMILES:

CCCC.CCCC[P+](CCCC)(CCCC)CP(=O)(O)O.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CCCC.CCCC[P+](CCCC)(CCCC)CP(=O)(O)O.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C13H30O3P2.C4H10.CHF3O3S/c1-4-7-10-17(11-8-5-2,12-9-6-3)13-18(14,15)16;1-3-4-2;2-1(3,4)8(5,6)7/h4-13H2,1-3H3,(H-,14,15,16);3-4H2,1-2H3;(H,5,6,7)