sodium 2,6-dicarboxybenzenesulfonate

Systemtic Name: sodium 2,6-dicarboxybenzenesulfonate Openeye Name: sodium 2,6-dicarboxybenzenesulfonate CAS Name: sodium 2,6-dicarboxybenzenesulfonate IUPAC Name: sodium 2,6-dicarboxybenzenesulfonate Traditional Name: sodium 2,6-dicarboxybesylate Formula: C8H5NaO7S MolecularWeight: 268.17587

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)C(=O)O)S(=O)(=O)[O-])C(=O)O.[Na+]

Isomeric SMILES

C1=CC(=C(C(=C1)C(=O)O)S(=O)(=O)[O-])C(=O)O.[Na+]

InChI

InChI=1S/C8H6O7S.Na/c9-7(10)4-2-1-3-5(8(11)12)6(4)16(13,14)15;/h1-3H,(H,9,10)(H,11,12)(H,13,14,15);/q;+1/p-1