3-fluoranyl-4-nitro-N-(6-phenylmethoxyquinolin-8-yl)benzenesulfonamide

Systemtic Name: 3-fluoranyl-4-nitro-N-(6-phenylmethoxyquinolin-8-yl)benzenesulfonamide Openeye Name: N-(6-benzyloxy-8-quinolyl)-3-fluoro-4-nitro-benzenesulfonamide CAS Name: 3-fluoro-4-nitro-N-(6-phenylmethoxy-8-quinolinyl)benzenesulfonamide IUPAC Name: 3-fluoro-4-nitro-N-(6-phenylmethoxyquinolin-8-yl)benzenesulfonamide Traditional Name: N-(6-benzoxy-8-quinolyl)-3-fluoro-4-nitro-benzenesulfonamide Formula: C22H16FN3O5S MolecularWeight: 453.442943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC(=C3C(=C2)C=CC=N3)NS(=O)(=O)C4=CC(=C(C=C4)[N+](=O)[O-])F

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC(=C3C(=C2)C=CC=N3)NS(=O)(=O)C4=CC(=C(C=C4)[N+](=O)[O-])F

InChI

InChI=1S/C22H16FN3O5S/c23-19-13-18(8-9-21(19)26(27)28)32(29,30)25-20-12-17(11-16-7-4-10-24-22(16)20)31-14-15-5-2-1-3-6-15/h1-13,25H,14H2