4-fluoranyl-N-[3-oxidanylidene-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-[3-oxidanylidene-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide Openeye Name: N-(4-benzyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-4-fluoro-benzenesulfonamide CAS Name: 4-fluoro-N-[3-oxo-4-(phenylmethyl)-5H-1,4-benzoxazepin-7-yl]benzenesulfonamide IUPAC Name: N-(4-benzyl-3-oxo-5H-1,4-benzoxazepin-7-yl)-4-fluorobenzenesulfonamide Traditional Name: N-(4-benzyl-3-keto-5H-1,4-benzoxazepin-7-yl)-4-fluoro-benzenesulfonamide Formula: C22H19FN2O4S MolecularWeight: 426.460663

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)F)OCC(=O)N1CC4=CC=CC=C4

Isomeric SMILES

C1C2=C(C=CC(=C2)NS(=O)(=O)C3=CC=C(C=C3)F)OCC(=O)N1CC4=CC=CC=C4

InChI

InChI=1S/C22H19FN2O4S/c23-18-6-9-20(10-7-18)30(27,28)24-19-8-11-21-17(12-19)14-25(22(26)15-29-21)13-16-4-2-1-3-5-16/h1-12,24H,13-15H2