(2-morpholin-4-yl-4-oxidanylidene-1H-quinolin-8-yl) 4-methylbenzenesulfonate

Systemtic Name: (2-morpholin-4-yl-4-oxidanylidene-1H-quinolin-8-yl) 4-methylbenzenesulfonate Openeye Name: (2-morpholino-4-oxo-1H-quinolin-8-yl) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-(4-morpholinyl)-4-oxo-1H-quinolin-8-yl] ester IUPAC Name: (2-morpholin-4-yl-4-oxo-1H-quinolin-8-yl) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (4-keto-2-morpholino-1H-quinolin-8-yl) ester Formula: C20H20N2O5S MolecularWeight: 400.4482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC3=C2NC(=CC3=O)N4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC3=C2NC(=CC3=O)N4CCOCC4

InChI

InChI=1S/C20H20N2O5S/c1-14-5-7-15(8-6-14)28(24,25)27-18-4-2-3-16-17(23)13-19(21-20(16)18)22-9-11-26-12-10-22/h2-8,13H,9-12H2,1H3,(H,21,23)