7-(2-hydroxyethyl-methyl-propyl-azaniumyl)icosane-1-sulfonate

Systemtic Name: 7-(2-hydroxyethyl-methyl-propyl-azaniumyl)icosane-1-sulfonate Openeye Name: 7-(2-hydroxyethyl-methyl-propyl-ammonio)icosane-1-sulfonate CAS Name: 7-(2-hydroxyethyl-methyl-propylammonio)-1-eicosanesulfonate IUPAC Name: 7-(2-hydroxyethyl-methyl-propylazaniumyl)icosane-1-sulfonate Traditional Name: 7-(2-hydroxyethyl-methyl-propyl-ammonio)eicosane-1-sulfonate Formula: C26H55NO4S MolecularWeight: 477.7842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(CCCCCCS(=O)(=O)[O-])[N+](C)(CCC)CCO

Isomeric SMILES

CCCCCCCCCCCCCC(CCCCCCS(=O)(=O)[O-])[N+](C)(CCC)CCO

InChI

InChI=1S/C26H55NO4S/c1-4-6-7-8-9-10-11-12-13-14-17-20-26(27(3,22-5-2)23-24-28)21-18-15-16-19-25-32(29,30)31/h26,28H,4-25H2,1-3H3