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

Systemtic Name: (1-methyl-2-oxidanylidene-3-phenyl-quinolin-4-yl) 4-methylbenzenesulfonate Openeye Name: (1-methyl-2-oxo-3-phenyl-4-quinolyl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (1-methyl-2-oxo-3-phenyl-4-quinolinyl) ester IUPAC Name: (1-methyl-2-oxo-3-phenylquinolin-4-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-keto-1-methyl-3-phenyl-4-quinolyl) ester Formula: C23H19NO4S MolecularWeight: 405.46626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=O)N(C3=CC=CC=C32)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=O)N(C3=CC=CC=C32)C)C4=CC=CC=C4

InChI

InChI=1S/C23H19NO4S/c1-16-12-14-18(15-13-16)29(26,27)28-22-19-10-6-7-11-20(19)24(2)23(25)21(22)17-8-4-3-5-9-17/h3-15H,1-2H3