(6,7-dimethoxy-2-oxidanylidene-3-phenyl-1H-quinolin-4-yl) 4-methylbenzenesulfonate

Systemtic Name: (6,7-dimethoxy-2-oxidanylidene-3-phenyl-1H-quinolin-4-yl) 4-methylbenzenesulfonate Openeye Name: (6,7-dimethoxy-2-oxo-3-phenyl-1H-quinolin-4-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (6,7-dimethoxy-2-oxo-3-phenyl-1H-quinolin-4-yl) ester IUPAC Name: (6,7-dimethoxy-2-oxo-3-phenyl-1H-quinolin-4-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-keto-6,7-dimethoxy-3-phenyl-1H-quinolin-4-yl) ester Formula: C24H21NO6S MolecularWeight: 451.49164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=O)NC3=CC(=C(C=C32)OC)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C(=O)NC3=CC(=C(C=C32)OC)OC)C4=CC=CC=C4

InChI

InChI=1S/C24H21NO6S/c1-15-9-11-17(12-10-15)32(27,28)31-23-18-13-20(29-2)21(30-3)14-19(18)25-24(26)22(23)16-7-5-4-6-8-16/h4-14H,1-3H3,(H,25,26)