sodium; 5-sulfobenzene-1,3-dicarboxylic acid

Systemtic Name: sodium; 5-sulfobenzene-1,3-dicarboxylic acid Openeye Name: sodium; 5-sulfobenzene-1,3-dicarboxylic acid CAS Name: sodium; 5-sulfobenzene-1,3-dicarboxylic acid IUPAC Name: sodium; 5-sulfobenzene-1,3-dicarboxylic acid Traditional Name: sodium; 5-sulfoisophthalic acid Formula: C8H6NaO7S MolecularWeight: 269.18381

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(=O)O)S(=O)(=O)O)C(=O)O.[Na]

Isomeric SMILES

C1=C(C=C(C=C1C(=O)O)S(=O)(=O)O)C(=O)O.[Na]

InChI

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