3-[[2-(hexadecylsulfanylmethyl)oxolan-2-yl]methylsulfamoyl]propyl-trimethyl-azanium

Systemtic Name: 3-[[2-(hexadecylsulfanylmethyl)oxolan-2-yl]methylsulfamoyl]propyl-trimethyl-azanium Openeye Name: 3-[[2-(hexadecylsulfanylmethyl)tetrahydrofuran-2-yl]methylsulfamoyl]propyl-trimethyl-ammonium CAS Name: 3-[[2-[(hexadecylthio)methyl]-2-oxolanyl]methylsulfamoyl]propyl-trimethylammonium IUPAC Name: 3-[[2-(hexadecylsulfanylmethyl)oxolan-2-yl]methylsulfamoyl]propyl-trimethylazanium Traditional Name: 3-[[2-[(cetylthio)methyl]tetrahydrofuran-2-yl]methylsulfamoyl]propyl-trimethyl-ammonium Formula: C28H59N2O3S2+ MolecularWeight: 535.90966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCSCC1(CCCO1)CNS(=O)(=O)CCC[N+](C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCSCC1(CCCO1)CNS(=O)(=O)CCC[N+](C)(C)C

InChI

InChI=1S/C28H59N2O3S2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-34-27-28(21-19-23-33-28)26-29-35(31,32)25-20-22-30(2,3)4/h29H,5-27H2,1-4H3/q+1