(1-methyl-7-methylsulfonyl-4-oxidanylidene-quinolin-3-yl) methanesulfonate

Systemtic Name: (1-methyl-7-methylsulfonyl-4-oxidanylidene-quinolin-3-yl) methanesulfonate Openeye Name: (1-methyl-7-methylsulfonyl-4-oxo-3-quinolyl) methanesulfonate CAS Name: methanesulfonic acid (1-methyl-7-methylsulfonyl-4-oxo-3-quinolinyl) ester IUPAC Name: (1-methyl-7-methylsulfonyl-4-oxoquinolin-3-yl) methanesulfonate Traditional Name: methanesulfonic acid (4-keto-7-mesyl-1-methyl-3-quinolyl) ester Formula: C12H13NO6S2 MolecularWeight: 331.36472

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)C2=C1C=C(C=C2)S(=O)(=O)C)OS(=O)(=O)C

Isomeric SMILES

CN1C=C(C(=O)C2=C1C=C(C=C2)S(=O)(=O)C)OS(=O)(=O)C

InChI

InChI=1S/C12H13NO6S2/c1-13-7-11(19-21(3,17)18)12(14)9-5-4-8(6-10(9)13)20(2,15)16/h4-7H,1-3H3