2,6-bis(methylsulfonyl)pyridine-4-carboxylic acid

Systemtic Name: 2,6-bis(methylsulfonyl)pyridine-4-carboxylic acid Openeye Name: 2,6-bis(methylsulfonyl)pyridine-4-carboxylic acid CAS Name: 2,6-bis(methylsulfonyl)-4-pyridinecarboxylic acid IUPAC Name: 2,6-bis(methylsulfonyl)pyridine-4-carboxylic acid Traditional Name: 2,6-dimesylisonicotinic acid Formula: C8H9NO6S2 MolecularWeight: 279.29016

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=CC(=N1)S(=O)(=O)C)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC(=CC(=N1)S(=O)(=O)C)C(=O)O

InChI

InChI=1S/C8H9NO6S2/c1-16(12,13)6-3-5(8(10)11)4-7(9-6)17(2,14)15/h3-4H,1-2H3,(H,10,11)