3-chloranyl-6-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-pyridine-2-carboxylic acid

Systemtic Name: 3-chloranyl-6-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-pyridine-2-carboxylic acid Openeye Name: 3-chloro-6-(2-methoxy-2-oxo-ethyl)sulfanyl-pyridine-2-carboxylic acid CAS Name: 3-chloro-6-[(2-methoxy-2-oxoethyl)thio]-2-pyridinecarboxylic acid IUPAC Name: 3-chloro-6-(2-methoxy-2-oxoethyl)sulfanylpyridine-2-carboxylic acid Traditional Name: 3-chloro-6-[(2-keto-2-methoxy-ethyl)thio]picolinic acid Formula: C9H8ClNO4S MolecularWeight: 261.68212

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC(=C(C=C1)Cl)C(=O)O

Isomeric SMILES

COC(=O)CSC1=NC(=C(C=C1)Cl)C(=O)O

InChI

InChI=1S/C9H8ClNO4S/c1-15-7(12)4-16-6-3-2-5(10)8(11-6)9(13)14/h2-3H,4H2,1H3,(H,13,14)