sodium 1,1-diethoxy-2-oxidanyl-3-oxidanylidene-tetradecane-1-sulfonate

Systemtic Name: sodium 1,1-diethoxy-2-oxidanyl-3-oxidanylidene-tetradecane-1-sulfonate Openeye Name: sodium 1,1-diethoxy-2-hydroxy-3-oxo-tetradecane-1-sulfonate CAS Name: sodium 1,1-diethoxy-2-hydroxy-3-oxo-1-tetradecanesulfonate IUPAC Name: sodium 1,1-diethoxy-2-hydroxy-3-oxotetradecane-1-sulfonate Traditional Name: sodium 1,1-diethoxy-2-hydroxy-3-keto-tetradecane-1-sulfonate Formula: C18H35NaO7S MolecularWeight: 418.52107

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)C(C(OCC)(OCC)S(=O)(=O)[O-])O.[Na+]

Isomeric SMILES

CCCCCCCCCCCC(=O)C(C(OCC)(OCC)S(=O)(=O)[O-])O.[Na+]

InChI

InChI=1S/C18H36O7S.Na/c1-4-7-8-9-10-11-12-13-14-15-16(19)17(20)18(24-5-2,25-6-3)26(21,22)23;/h17,20H,4-15H2,1-3H3,(H,21,22,23);/q;+1/p-1