4-(2-ethoxy-3-hexadecylsulfanyl-propoxy)butyl-trimethyl-azanium

Systemtic Name: 4-(2-ethoxy-3-hexadecylsulfanyl-propoxy)butyl-trimethyl-azanium Openeye Name: 4-(2-ethoxy-3-hexadecylsulfanyl-propoxy)butyl-trimethyl-ammonium CAS Name: 4-[2-ethoxy-3-(hexadecylthio)propoxy]butyl-trimethylammonium IUPAC Name: 4-(2-ethoxy-3-hexadecylsulfanylpropoxy)butyl-trimethylazanium Traditional Name: 4-[3-(cetylthio)-2-ethoxy-propoxy]butyl-trimethyl-ammonium Formula: C28H60NO2S+ MolecularWeight: 474.8465

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSCC(COCCCC[N+](C)(C)C)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCCSCC(COCCCC[N+](C)(C)C)OCC

InChI

InChI=1S/C28H60NO2S/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-22-25-32-27-28(31-7-2)26-30-24-21-20-23-29(3,4)5/h28H,6-27H2,1-5H3/q+1