2-[(2-ethoxy-3-octadecylsulfonyl-propoxy)-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium

Systemtic Name: 2-[(2-ethoxy-3-octadecylsulfonyl-propoxy)-oxidanyl-phosphoryl]oxyethyl-trimethyl-azanium Openeye Name: 2-[(2-ethoxy-3-octadecylsulfonyl-propoxy)-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium CAS Name: 2-[(2-ethoxy-3-octadecylsulfonylpropoxy)-hydroxyphosphoryl]oxyethyl-trimethylammonium IUPAC Name: 2-[(2-ethoxy-3-octadecylsulfonylpropoxy)-hydroxyphosphoryl]oxyethyl-trimethylazanium Traditional Name: 2-[(2-ethoxy-3-stearylsulfonyl-propoxy)-hydroxy-phosphoryl]oxyethyl-trimethyl-ammonium Formula: C28H61NO7PS+ MolecularWeight: 586.825201

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCS(=O)(=O)CC(COP(=O)(O)OCC[N+](C)(C)C)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCS(=O)(=O)CC(COP(=O)(O)OCC[N+](C)(C)C)OCC

InChI

InChI=1S/C28H60NO7PS/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25-38(32,33)27-28(34-7-2)26-36-37(30,31)35-24-23-29(3,4)5/h28H,6-27H2,1-5H3/p+1