4-[methyl(2-oxidanylundecyl)azaniumylidene]butane-1-sulfonate

Systemtic Name: 4-[methyl(2-oxidanylundecyl)azaniumylidene]butane-1-sulfonate Openeye Name: 4-[2-hydroxyundecyl(methyl)iminio]butane-1-sulfonate CAS Name: 4-[2-hydroxyundecyl(methyl)iminio]-1-butanesulfonate IUPAC Name: 4-[2-hydroxyundecyl(methyl)azaniumylidene]butane-1-sulfonate Traditional Name: 4-[2-hydroxyundecyl(methyl)iminio]butane-1-sulfonate Formula: C16H33NO4S MolecularWeight: 335.50252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C[N+](=CCCCS(=O)(=O)[O-])C)O

Isomeric SMILES

CCCCCCCCCC(C[N+](=CCCCS(=O)(=O)[O-])C)O

InChI

InChI=1S/C16H33NO4S/c1-3-4-5-6-7-8-9-12-16(18)15-17(2)13-10-11-14-22(19,20)21/h13,16,18H,3-12,14-15H2,1-2H3