ethyl-icosyl-methyl-azanium; 2-oxidanyltricosane-1-sulfonate

Systemtic Name: ethyl-icosyl-methyl-azanium; 2-oxidanyltricosane-1-sulfonate Openeye Name: ethyl-icosyl-methyl-ammonium; 2-hydroxytricosane-1-sulfonate CAS Name: eicosyl-ethyl-methylammonium; 2-hydroxy-1-tricosanesulfonate IUPAC Name: ethyl-icosyl-methylazanium; 2-hydroxytricosane-1-sulfonate Traditional Name: arachyl-ethyl-methyl-ammonium; 2-hydroxytricosane-1-sulfonate Formula: C46H97NO4S MolecularWeight: 760.33168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(CS(=O)(=O)[O-])O.CCCCCCCCCCCCCCCCCCCC[NH+](C)CC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(CS(=O)(=O)[O-])O.CCCCCCCCCCCCCCCCCCCC[NH+](C)CC

InChI

InChI=1S/C23H49N.C23H48O4S/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(3)5-2;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-23(24)22-28(25,26)27/h4-23H2,1-3H3;23-24H,2-22H2,1H3,(H,25,26,27)