3-methylsulfanylpyridine-2,5-dicarboxylic acid

Systemtic Name: 3-methylsulfanylpyridine-2,5-dicarboxylic acid Openeye Name: 3-methylsulfanylpyridine-2,5-dicarboxylic acid CAS Name: 3-(methylthio)pyridine-2,5-dicarboxylic acid IUPAC Name: 3-methylsulfanylpyridine-2,5-dicarboxylic acid Traditional Name: 3-(methylthio)isocinchomeronic acid Formula: C8H7NO4S MolecularWeight: 213.21048

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(N=CC(=C1)C(=O)O)C(=O)O

Isomeric SMILES

CSC1=C(N=CC(=C1)C(=O)O)C(=O)O

InChI

InChI=1S/C8H7NO4S/c1-14-5-2-4(7(10)11)3-9-6(5)8(12)13/h2-3H,1H3,(H,10,11)(H,12,13)