(7-methoxy-1-methyl-2-oxidanylidene-3-phenyl-quinolin-4-yl) 4-methylbenzenesulfonate

Systemtic Name: (7-methoxy-1-methyl-2-oxidanylidene-3-phenyl-quinolin-4-yl) 4-methylbenzenesulfonate Openeye Name: (7-methoxy-1-methyl-2-oxo-3-phenyl-4-quinolyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (7-methoxy-1-methyl-2-oxo-3-phenyl-4-quinolinyl) ester IUPAC Name: (7-methoxy-1-methyl-2-oxo-3-phenylquinolin-4-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-keto-7-methoxy-1-methyl-3-phenyl-4-quinolyl) ester Formula: C24H21NO5S MolecularWeight: 435.49224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=O)N(C3=C2C=CC(=C3)OC)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=O)N(C3=C2C=CC(=C3)OC)C)C4=CC=CC=C4

InChI

InChI=1S/C24H21NO5S/c1-16-9-12-19(13-10-16)31(27,28)30-23-20-14-11-18(29-3)15-21(20)25(2)24(26)22(23)17-7-5-4-6-8-17/h4-15H,1-3H3