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

Systemtic Name: [4-[diethoxyphosphoryl(oxidanyl)methyl]phenyl]-trimethyl-azanium; methyl sulfate Openeye Name: [4-[diethoxyphosphoryl(hydroxy)methyl]phenyl]-trimethyl-ammonium; methyl sulfate CAS Name: [4-[diethoxyphosphoryl(hydroxy)methyl]phenyl]-trimethylammonium; methyl sulfate IUPAC Name: [4-[diethoxyphosphoryl(hydroxy)methyl]phenyl]-trimethylazanium; methyl sulfate Traditional Name: [4-[diethoxyphosphoryl(hydroxy)methyl]phenyl]-trimethyl-ammonium; methyl sulfate Formula: C15H28NO8PS MolecularWeight: 413.423481

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(C1=CC=C(C=C1)[N+](C)(C)C)O)OCC.COS(=O)(=O)[O-]

Isomeric SMILES

CCOP(=O)(C(C1=CC=C(C=C1)[N+](C)(C)C)O)OCC.COS(=O)(=O)[O-]

InChI

InChI=1S/C14H25NO4P.CH4O4S/c1-6-18-20(17,19-7-2)14(16)12-8-10-13(11-9-12)15(3,4)5;1-5-6(2,3)4/h8-11,14,16H,6-7H2,1-5H3;1H3,(H,2,3,4)/q+1;/p-1