hexadecylazanium; methyl butane-2-sulfonate

Systemtic Name: hexadecylazanium; methyl butane-2-sulfonate Openeye Name: hexadecylammonium; methyl butane-2-sulfonate CAS Name: 2-butanesulfonic acid; hexadecylammonium IUPAC Name: hexadecylazanium; methyl butane-2-sulfonate Traditional Name: butane-2-sulfonic acid methyl ester; cetylammonium Formula: C21H48NO3S+ MolecularWeight: 394.67572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[NH3+].CCC(C)S(=O)(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCCCC[NH3+].CCC(C)S(=O)(=O)OC

InChI

InChI=1S/C16H35N.C5H12O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17;1-4-5(2)9(6,7)8-3/h2-17H2,1H3;5H,4H2,1-3H3/p+1