[4-[dimethoxyphosphoryl(oxidanyl)methyl]phenyl]-trimethyl-azanium; methyl sulfate

Systemtic Name: [4-[dimethoxyphosphoryl(oxidanyl)methyl]phenyl]-trimethyl-azanium; methyl sulfate Openeye Name: [4-[dimethoxyphosphoryl(hydroxy)methyl]phenyl]-trimethyl-ammonium; methyl sulfate CAS Name: [4-[dimethoxyphosphoryl(hydroxy)methyl]phenyl]-trimethylammonium; methyl sulfate IUPAC Name: [4-[dimethoxyphosphoryl(hydroxy)methyl]phenyl]-trimethylazanium; methyl sulfate Traditional Name: [4-[dimethoxyphosphoryl(hydroxy)methyl]phenyl]-trimethyl-ammonium; methyl sulfate Formula: C13H24NO8PS MolecularWeight: 385.370321

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C1=CC=C(C=C1)C(O)P(=O)(OC)OC.COS(=O)(=O)[O-]

Isomeric SMILES

C[N+](C)(C)C1=CC=C(C=C1)C(O)P(=O)(OC)OC.COS(=O)(=O)[O-]

InChI

InChI=1S/C12H21NO4P.CH4O4S/c1-13(2,3)11-8-6-10(7-9-11)12(14)18(15,16-4)17-5;1-5-6(2,3)4/h6-9,12,14H,1-5H3;1H3,(H,2,3,4)/q+1;/p-1