6-methylsulfanyl-5-propoxy-pyridine-3-carboxylic acid

Systemtic Name: 6-methylsulfanyl-5-propoxy-pyridine-3-carboxylic acid Openeye Name: 6-methylsulfanyl-5-propoxy-pyridine-3-carboxylic acid CAS Name: 6-(methylthio)-5-propoxy-3-pyridinecarboxylic acid IUPAC Name: 6-methylsulfanyl-5-propoxypyridine-3-carboxylic acid Traditional Name: 6-(methylthio)-5-propoxy-nicotinic acid Formula: C10H13NO3S MolecularWeight: 227.28012

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(N=CC(=C1)C(=O)O)SC

Isomeric SMILES

CCCOC1=C(N=CC(=C1)C(=O)O)SC

InChI

InChI=1S/C10H13NO3S/c1-3-4-14-8-5-7(10(12)13)6-11-9(8)15-2/h5-6H,3-4H2,1-2H3,(H,12,13)