3-chloranyl-4-fluoranyl-N-(5-oxidanylidene-4-phenyl-2,3-dihydro-1,4-benzoxazepin-7-yl)benzenesulfonamide

Systemtic Name: 3-chloranyl-4-fluoranyl-N-(5-oxidanylidene-4-phenyl-2,3-dihydro-1,4-benzoxazepin-7-yl)benzenesulfonamide Openeye Name: 3-chloro-4-fluoro-N-(5-oxo-4-phenyl-2,3-dihydro-1,4-benzoxazepin-7-yl)benzenesulfonamide CAS Name: 3-chloro-4-fluoro-N-(5-oxo-4-phenyl-2,3-dihydro-1,4-benzoxazepin-7-yl)benzenesulfonamide IUPAC Name: 3-chloro-4-fluoro-N-(5-oxo-4-phenyl-2,3-dihydro-1,4-benzoxazepin-7-yl)benzenesulfonamide Traditional Name: 3-chloro-4-fluoro-N-(5-keto-4-phenyl-2,3-dihydro-1,4-benzoxazepin-7-yl)benzenesulfonamide Formula: C21H16ClFN2O4S MolecularWeight: 446.879143

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)F)Cl)C(=O)N1C4=CC=CC=C4

Isomeric SMILES

C1COC2=C(C=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)F)Cl)C(=O)N1C4=CC=CC=C4

InChI

InChI=1S/C21H16ClFN2O4S/c22-18-13-16(7-8-19(18)23)30(27,28)24-14-6-9-20-17(12-14)21(26)25(10-11-29-20)15-4-2-1-3-5-15/h1-9,12-13,24H,10-11H2