dimethyl(octadecyl)azanium; 2-oxidanylpropane-1-sulfonate

Systemtic Name: dimethyl(octadecyl)azanium; 2-oxidanylpropane-1-sulfonate Openeye Name: dimethyl(octadecyl)ammonium; 2-hydroxypropane-1-sulfonate CAS Name: dimethyl(octadecyl)ammonium; 2-hydroxy-1-propanesulfonate IUPAC Name: dimethyl(octadecyl)azanium; 2-hydroxypropane-1-sulfonate Traditional Name: dimethyl(stearyl)ammonium; 2-hydroxypropane-1-sulfonate Formula: C23H51NO4S MolecularWeight: 437.72034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H43N.C3H8O4S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(2)3;1-3(4)2-8(5,6)7/h4-20H2,1-3H3;3-4H,2H2,1H3,(H,5,6,7)