2-[[3,5-bis(methoxycarbonyl)phenyl]sulfonylamino]ethanesulfonate; tetrabutylphosphanium

Systemtic Name: 2-[[3,5-bis(methoxycarbonyl)phenyl]sulfonylamino]ethanesulfonate; tetrabutylphosphanium Openeye Name: 2-[[3,5-bis(methoxycarbonyl)phenyl]sulfonylamino]ethanesulfonate; tetrabutylphosphonium CAS Name: 2-[[3,5-bis(methoxycarbonyl)phenyl]sulfonylamino]ethanesulfonate; tetrabutylphosphonium IUPAC Name: 2-[[3,5-bis(methoxycarbonyl)phenyl]sulfonylamino]ethanesulfonate; tetrabutylphosphanium Traditional Name: 2-[(3,5-dicarbomethoxyphenyl)sulfonylamino]ethanesulfonate; tetrabutylphosphonium Formula: C28H50NO9PS2 MolecularWeight: 639.801661

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[P+](CCCC)(CCCC)CCCC.COC(=O)C1=CC(=CC(=C1)S(=O)(=O)NCCS(=O)(=O)[O-])C(=O)OC

Isomeric SMILES

CCCC[P+](CCCC)(CCCC)CCCC.COC(=O)C1=CC(=CC(=C1)S(=O)(=O)NCCS(=O)(=O)[O-])C(=O)OC

InChI

InChI=1S/C16H36P.C12H15NO9S2/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;1-21-11(14)8-5-9(12(15)22-2)7-10(6-8)24(19,20)13-3-4-23(16,17)18/h5-16H2,1-4H3;5-7,13H,3-4H2,1-2H3,(H,16,17,18)/q+1;/p-1