8-methylsulfonyl-4-oxidanylidene-1H-quinoline-3-carboxylic acid

Systemtic Name: 8-methylsulfonyl-4-oxidanylidene-1H-quinoline-3-carboxylic acid Openeye Name: 8-methylsulfonyl-4-oxo-1H-quinoline-3-carboxylic acid CAS Name: 8-methylsulfonyl-4-oxo-1H-quinoline-3-carboxylic acid IUPAC Name: 8-methylsulfonyl-4-oxo-1H-quinoline-3-carboxylic acid Traditional Name: 4-keto-8-mesyl-1H-quinoline-3-carboxylic acid Formula: C11H9NO5S MolecularWeight: 267.25786

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC2=C1NC=C(C2=O)C(=O)O

Isomeric SMILES

CS(=O)(=O)C1=CC=CC2=C1NC=C(C2=O)C(=O)O

InChI

InChI=1S/C11H9NO5S/c1-18(16,17)8-4-2-3-6-9(8)12-5-7(10(6)13)11(14)15/h2-5H,1H3,(H,12,13)(H,14,15)