2-nonylbenzenesulfonate; tris(2-hydroxyethyl)azanium

Systemtic Name: 2-nonylbenzenesulfonate; tris(2-hydroxyethyl)azanium Openeye Name: 2-nonylbenzenesulfonate; tris(2-hydroxyethyl)ammonium CAS Name: 2-nonylbenzenesulfonate; tris(2-hydroxyethyl)ammonium IUPAC Name: 2-nonylbenzenesulfonate; tris(2-hydroxyethyl)azanium Traditional Name: 2-nonylbesylate; tris(2-hydroxyethyl)ammonium Formula: C21H39NO6S MolecularWeight: 433.60246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].C(CO)[NH+](CCO)CCO

Isomeric SMILES

CCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].C(CO)[NH+](CCO)CCO

InChI

InChI=1S/C15H24O3S.C6H15NO3/c1-2-3-4-5-6-7-8-11-14-12-9-10-13-15(14)19(16,17)18;8-4-1-7(2-5-9)3-6-10/h9-10,12-13H,2-8,11H2,1H3,(H,16,17,18);8-10H,1-6H2