sodium 2-ethoxysulfonylbutanedioate

Systemtic Name: sodium 2-ethoxysulfonylbutanedioate Openeye Name: sodium 2-ethoxysulfonylbutanedioate CAS Name: sodium 2-ethoxysulfonylbutanedioate IUPAC Name: sodium 2-ethoxysulfonylbutanedioate Traditional Name: sodium 2-ethoxysulfonylsuccinate Formula: C12H16NaO14S2-3 MolecularWeight: 471.36681

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Descriptors Computed from Structure

Canonical SMILES:

CCOS(=O)(=O)C(CC(=O)[O-])C(=O)[O-].CCOS(=O)(=O)C(CC(=O)[O-])C(=O)[O-].[Na+]

Isomeric SMILES

CCOS(=O)(=O)C(CC(=O)[O-])C(=O)[O-].CCOS(=O)(=O)C(CC(=O)[O-])C(=O)[O-].[Na+]

InChI

InChI=1S/2C6H10O7S.Na/c2*1-2-13-14(11,12)4(6(9)10)3-5(7)8;/h2*4H,2-3H2,1H3,(H,7,8)(H,9,10);/q;;+1/p-4