(6-methoxy-7-methyl-4-oxidanylidene-1H-quinolin-3-yl) ethanesulfonate

Systemtic Name: (6-methoxy-7-methyl-4-oxidanylidene-1H-quinolin-3-yl) ethanesulfonate Openeye Name: (6-methoxy-7-methyl-4-oxo-1H-quinolin-3-yl) ethanesulfonate CAS Name: ethanesulfonic acid (6-methoxy-7-methyl-4-oxo-1H-quinolin-3-yl) ester IUPAC Name: (6-methoxy-7-methyl-4-oxo-1H-quinolin-3-yl) ethanesulfonate Traditional Name: ethanesulfonic acid (4-keto-6-methoxy-7-methyl-1H-quinolin-3-yl) ester Formula: C13H15NO5S MolecularWeight: 297.3269

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=CNC2=CC(=C(C=C2C1=O)OC)C

Isomeric SMILES

CCS(=O)(=O)OC1=CNC2=CC(=C(C=C2C1=O)OC)C

InChI

InChI=1S/C13H15NO5S/c1-4-20(16,17)19-12-7-14-10-5-8(2)11(18-3)6-9(10)13(12)15/h5-7H,4H2,1-3H3,(H,14,15)