7-methylsulfanyl-4-oxidanylidene-1H-quinoline-3-carboxylic acid

Systemtic Name: 7-methylsulfanyl-4-oxidanylidene-1H-quinoline-3-carboxylic acid Openeye Name: 7-methylsulfanyl-4-oxo-1H-quinoline-3-carboxylic acid CAS Name: 7-(methylthio)-4-oxo-1H-quinoline-3-carboxylic acid IUPAC Name: 7-methylsulfanyl-4-oxo-1H-quinoline-3-carboxylic acid Traditional Name: 4-keto-7-(methylthio)-1H-quinoline-3-carboxylic acid Formula: C11H9NO3S MolecularWeight: 235.25906

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC2=C(C=C1)C(=O)C(=CN2)C(=O)O

Isomeric SMILES

CSC1=CC2=C(C=C1)C(=O)C(=CN2)C(=O)O

InChI

InChI=1S/C11H9NO3S/c1-16-6-2-3-7-9(4-6)12-5-8(10(7)13)11(14)15/h2-5H,1H3,(H,12,13)(H,14,15)