2-oxidanylidene-5-sulfo-1H-pyridine-3-carboxylic acid

Systemtic Name: 2-oxidanylidene-5-sulfo-1H-pyridine-3-carboxylic acid Openeye Name: 2-oxo-5-sulfo-1H-pyridine-3-carboxylic acid CAS Name: 2-oxo-5-sulfo-1H-pyridine-3-carboxylic acid IUPAC Name: 2-oxo-5-sulfo-1H-pyridine-3-carboxylic acid Traditional Name: 2-keto-5-sulfo-1H-pyridine-3-carboxylic acid Formula: C6H5NO6S MolecularWeight: 219.172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H5NO6S/c8-5-4(6(9)10)1-3(2-7-5)14(11,12)13/h1-2H,(H,7,8)(H,9,10)(H,11,12,13)