(3-ethyl-1-methyl-2-oxidanylidene-quinolin-4-yl) 4-methylbenzenesulfonate

Systemtic Name: (3-ethyl-1-methyl-2-oxidanylidene-quinolin-4-yl) 4-methylbenzenesulfonate Openeye Name: (3-ethyl-1-methyl-2-oxo-4-quinolyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (3-ethyl-1-methyl-2-oxo-4-quinolinyl) ester IUPAC Name: (3-ethyl-1-methyl-2-oxoquinolin-4-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (3-ethyl-2-keto-1-methyl-4-quinolyl) ester Formula: C19H19NO4S MolecularWeight: 357.42346

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2N(C1=O)C)OS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC1=C(C2=CC=CC=C2N(C1=O)C)OS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C19H19NO4S/c1-4-15-18(16-7-5-6-8-17(16)20(3)19(15)21)24-25(22,23)14-11-9-13(2)10-12-14/h5-12H,4H2,1-3H3