3-[(2-hexadecoxy-3-hexadecylsulfonyl-propoxy)-oxidanyl-phosphoryl]propyl-trimethyl-azanium

Systemtic Name: 3-[(2-hexadecoxy-3-hexadecylsulfonyl-propoxy)-oxidanyl-phosphoryl]propyl-trimethyl-azanium Openeye Name: 3-[(2-hexadecoxy-3-hexadecylsulfonyl-propoxy)-hydroxy-phosphoryl]propyl-trimethyl-ammonium CAS Name: 3-[(2-hexadecoxy-3-hexadecylsulfonylpropoxy)-hydroxyphosphoryl]propyl-trimethylammonium IUPAC Name: 3-[(2-hexadecoxy-3-hexadecylsulfonylpropoxy)-hydroxyphosphoryl]propyl-trimethylazanium Traditional Name: 3-[(2-cetyloxy-3-cetylsulfonyl-propoxy)-hydroxy-phosphoryl]propyl-trimethyl-ammonium Formula: C41H87NO6PS+ MolecularWeight: 753.171341

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(COP(=O)(CCC[N+](C)(C)C)O)CS(=O)(=O)CCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(COP(=O)(CCC[N+](C)(C)C)O)CS(=O)(=O)CCCCCCCCCCCCCCCC

InChI

InChI=1S/C41H86NO6PS/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-36-47-41(39-48-49(43,44)37-34-35-42(3,4)5)40-50(45,46)38-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h41H,6-40H2,1-5H3/p+1