sodium; 2-carboxyoxysulfanylbutanedioic acid; hydrogen carbonate

Systemtic Name: sodium; 2-carboxyoxysulfanylbutanedioic acid; hydrogen carbonate Openeye Name: sodium; 2-carboxyoxysulfanylbutanedioic acid; hydrogen carbonate CAS Name: sodium; 2-(carboxyoxythio)butanedioic acid; hydrogen carbonate IUPAC Name: sodium; 2-carboxyoxysulfanylbutanedioic acid; hydrogen carbonate Traditional Name: sodium 2-(carboxyoxythio)succinic acid bicarbonate Formula: C6H7NaO10S MolecularWeight: 294.16855

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Descriptors Computed from Structure

Canonical SMILES:

C(C(C(=O)O)SOC(=O)O)C(=O)O.C(=O)(O)[O-].[Na+]

Isomeric SMILES

C(C(C(=O)O)SOC(=O)O)C(=O)O.C(=O)(O)[O-].[Na+]

InChI

InChI=1S/C5H6O7S.CH2O3.Na/c6-3(7)1-2(4(8)9)13-12-5(10)11;2-1(3)4;/h2H,1H2,(H,6,7)(H,8,9)(H,10,11);(H2,2,3,4);/q;;+1/p-1