sodium 1-(2-ethoxyethoxy)-3-(3-ethoxypropanoyloxy)-1-oxidanylidene-butane-2-sulfonate

Systemtic Name: sodium 1-(2-ethoxyethoxy)-3-(3-ethoxypropanoyloxy)-1-oxidanylidene-butane-2-sulfonate Openeye Name: sodium 1-(2-ethoxyethoxy)-3-(3-ethoxypropanoyloxy)-1-oxo-butane-2-sulfonate CAS Name: sodium 1-(2-ethoxyethoxy)-3-(3-ethoxy-1-oxopropoxy)-1-oxo-2-butanesulfonate IUPAC Name: sodium 1-(2-ethoxyethoxy)-3-(3-ethoxypropanoyloxy)-1-oxobutane-2-sulfonate Traditional Name: sodium 1-(2-ethoxyethoxy)-3-(3-ethoxypropanoyloxy)-1-keto-butane-2-sulfonate Formula: C13H23NaO9S MolecularWeight: 378.37109

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCC(=O)OC(C)C(C(=O)OCCOCC)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCOCCC(=O)OC(C)C(C(=O)OCCOCC)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C13H24O9S.Na/c1-4-19-7-6-11(14)22-10(3)12(23(16,17)18)13(15)21-9-8-20-5-2;/h10,12H,4-9H2,1-3H3,(H,16,17,18);/q;+1/p-1