5-methylsulfonylpyridine-3-carboxylic acid

Systemtic Name: 5-methylsulfonylpyridine-3-carboxylic acid Openeye Name: 5-methylsulfonylpyridine-3-carboxylic acid CAS Name: 5-methylsulfonyl-3-pyridinecarboxylic acid IUPAC Name: 5-methylsulfonylpyridine-3-carboxylic acid Traditional Name: 5-mesylnicotinic acid Formula: C7H7NO4S MolecularWeight: 201.19978

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CN=CC(=C1)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CN=CC(=C1)C(=O)O

InChI

InChI=1S/C7H7NO4S/c1-13(11,12)6-2-5(7(9)10)3-8-4-6/h2-4H,1H3,(H,9,10)