3-sulfopyridine-2,6-dicarboxylic acid

Systemtic Name: 3-sulfopyridine-2,6-dicarboxylic acid Openeye Name: 3-sulfopyridine-2,6-dicarboxylic acid CAS Name: 3-sulfopyridine-2,6-dicarboxylic acid IUPAC Name: 3-sulfopyridine-2,6-dicarboxylic acid Traditional Name: 3-sulfodipicolinic acid Formula: C7H5NO7S MolecularWeight: 247.1821

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC(=C1S(=O)(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=NC(=C1S(=O)(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C7H5NO7S/c9-6(10)3-1-2-4(16(13,14)15)5(8-3)7(11)12/h1-2H,(H,9,10)(H,11,12)(H,13,14,15)