3-[[2-(hexadecoxymethyl)-3-methoxy-propyl]sulfamoyl]propyl-trimethyl-azanium iodide

Systemtic Name: 3-[[2-(hexadecoxymethyl)-3-methoxy-propyl]sulfamoyl]propyl-trimethyl-azanium iodide Openeye Name: 3-[[2-(hexadecoxymethyl)-3-methoxy-propyl]sulfamoyl]propyl-trimethyl-ammonium iodide CAS Name: 3-[[2-(hexadecoxymethyl)-3-methoxypropyl]sulfamoyl]propyl-trimethylammonium iodide IUPAC Name: 3-[[2-(hexadecoxymethyl)-3-methoxypropyl]sulfamoyl]propyl-trimethylazanium iodide Traditional Name: 3-[[2-(cetyloxymethyl)-3-methoxy-propyl]sulfamoyl]propyl-trimethyl-ammonium iodide Formula: C27H59IN2O4S MolecularWeight: 634.73783

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(CNS(=O)(=O)CCC[N+](C)(C)C)COC.[I-]

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(CNS(=O)(=O)CCC[N+](C)(C)C)COC.[I-]

InChI

InChI=1S/C27H59N2O4S.HI/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-33-26-27(25-32-5)24-28-34(30,31)23-20-21-29(2,3)4;/h27-28H,6-26H2,1-5H3;1H/q+1;/p-1