[1-ethyl-7-methoxy-3-(4-methoxyphenyl)-2-oxidanylidene-quinolin-4-yl] 4-methylbenzenesulfonate

Systemtic Name: [1-ethyl-7-methoxy-3-(4-methoxyphenyl)-2-oxidanylidene-quinolin-4-yl] 4-methylbenzenesulfonate Openeye Name: [1-ethyl-7-methoxy-3-(4-methoxyphenyl)-2-oxo-4-quinolyl] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [1-ethyl-7-methoxy-3-(4-methoxyphenyl)-2-oxo-4-quinolinyl] ester IUPAC Name: [1-ethyl-7-methoxy-3-(4-methoxyphenyl)-2-oxoquinolin-4-yl] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [1-ethyl-2-keto-7-methoxy-3-(4-methoxyphenyl)-4-quinolyl] ester Formula: C26H25NO6S MolecularWeight: 479.5448

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=CC(=C2)OC)C(=C(C1=O)C3=CC=C(C=C3)OC)OS(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCN1C2=C(C=CC(=C2)OC)C(=C(C1=O)C3=CC=C(C=C3)OC)OS(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C26H25NO6S/c1-5-27-23-16-20(32-4)12-15-22(23)25(33-34(29,30)21-13-6-17(2)7-14-21)24(26(27)28)18-8-10-19(31-3)11-9-18/h6-16H,5H2,1-4H3