bis(diethoxyphosphoryl)methyl-trimethyl-azanium; methyl sulfate

Systemtic Name: bis(diethoxyphosphoryl)methyl-trimethyl-azanium; methyl sulfate Openeye Name: bis(diethoxyphosphoryl)methyl-trimethyl-ammonium; methyl sulfate CAS Name: bis(diethoxyphosphoryl)methyl-trimethylammonium; methyl sulfate IUPAC Name: bis(diethoxyphosphoryl)methyl-trimethylazanium; methyl sulfate Traditional Name: bis(diethoxyphosphoryl)methyl-trimethyl-ammonium; methyl sulfate Formula: C13H33NO10P2S MolecularWeight: 457.414342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C([N+](C)(C)C)P(=O)(OCC)OCC)OCC.COS(=O)(=O)[O-]

Isomeric SMILES

CCOP(=O)(C([N+](C)(C)C)P(=O)(OCC)OCC)OCC.COS(=O)(=O)[O-]

InChI

InChI=1S/C12H30NO6P2.CH4O4S/c1-8-16-20(14,17-9-2)12(13(5,6)7)21(15,18-10-3)19-11-4;1-5-6(2,3)4/h12H,8-11H2,1-7H3;1H3,(H,2,3,4)/q+1;/p-1