[2-oxidanylidene-1-phenyl-3-(phenylmethyl)quinolin-4-yl] benzenesulfonate

Systemtic Name: [2-oxidanylidene-1-phenyl-3-(phenylmethyl)quinolin-4-yl] benzenesulfonate Openeye Name: (3-benzyl-2-oxo-1-phenyl-4-quinolyl) benzenesulfonate CAS Name: benzenesulfonic acid [2-oxo-1-phenyl-3-(phenylmethyl)-4-quinolinyl] ester IUPAC Name: (3-benzyl-2-oxo-1-phenylquinolin-4-yl) benzenesulfonate Traditional Name: benzenesulfonic acid (3-benzyl-2-keto-1-phenyl-4-quinolyl) ester Formula: C28H21NO4S MolecularWeight: 467.53564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(C3=CC=CC=C3N(C2=O)C4=CC=CC=C4)OS(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(C3=CC=CC=C3N(C2=O)C4=CC=CC=C4)OS(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C28H21NO4S/c30-28-25(20-21-12-4-1-5-13-21)27(33-34(31,32)23-16-8-3-9-17-23)24-18-10-11-19-26(24)29(28)22-14-6-2-7-15-22/h1-19H,20H2