(1,7-dimethyl-4-oxidanylidene-quinolin-3-yl) methanesulfonate

Systemtic Name: (1,7-dimethyl-4-oxidanylidene-quinolin-3-yl) methanesulfonate Openeye Name: (1,7-dimethyl-4-oxo-3-quinolyl) methanesulfonate CAS Name: methanesulfonic acid (1,7-dimethyl-4-oxo-3-quinolinyl) ester IUPAC Name: (1,7-dimethyl-4-oxoquinolin-3-yl) methanesulfonate Traditional Name: methanesulfonic acid (4-keto-1,7-dimethyl-3-quinolyl) ester Formula: C12H13NO4S MolecularWeight: 267.30092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)C(=CN2C)OS(=O)(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)C(=CN2C)OS(=O)(=O)C

InChI

InChI=1S/C12H13NO4S/c1-8-4-5-9-10(6-8)13(2)7-11(12(9)14)17-18(3,15)16/h4-7H,1-3H3