5-methylsulfonylpyridine-3-carboxylate

Systemtic Name: 5-methylsulfonylpyridine-3-carboxylate Openeye Name: 5-methylsulfonylpyridine-3-carboxylate CAS Name: 5-methylsulfonyl-3-pyridinecarboxylate IUPAC Name: 5-methylsulfonylpyridine-3-carboxylate Traditional Name: 5-mesylnicotinate Formula: C7H6NO4S- MolecularWeight: 200.19184

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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)/p-1