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

Systemtic Name: [4-[dipropoxyphosphoryl(oxidanyl)methyl]phenyl]-trimethyl-azanium; methyl sulfate Openeye Name: [4-[dipropoxyphosphoryl(hydroxy)methyl]phenyl]-trimethyl-ammonium; methyl sulfate CAS Name: [4-[dipropoxyphosphoryl(hydroxy)methyl]phenyl]-trimethylammonium; methyl sulfate IUPAC Name: [4-[dipropoxyphosphoryl(hydroxy)methyl]phenyl]-trimethylazanium; methyl sulfate Traditional Name: [4-[dipropoxyphosphoryl(hydroxy)methyl]phenyl]-trimethyl-ammonium; methyl sulfate Formula: C17H32NO8PS MolecularWeight: 441.476641

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Descriptors Computed from Structure

Canonical SMILES:

CCCOP(=O)(C(C1=CC=C(C=C1)[N+](C)(C)C)O)OCCC.COS(=O)(=O)[O-]

Isomeric SMILES

CCCOP(=O)(C(C1=CC=C(C=C1)[N+](C)(C)C)O)OCCC.COS(=O)(=O)[O-]

InChI

InChI=1S/C16H29NO4P.CH4O4S/c1-6-12-20-22(19,21-13-7-2)16(18)14-8-10-15(11-9-14)17(3,4)5;1-5-6(2,3)4/h8-11,16,18H,6-7,12-13H2,1-5H3;1H3,(H,2,3,4)/q+1;/p-1