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

Systemtic Name: 3-chloranyl-N-(3,3-dimethyl-5-oxidanylidene-2,4-dihydro-1,4-benzoxazepin-7-yl)-4-fluoranyl-benzenesulfonamide Openeye Name: 3-chloro-N-(3,3-dimethyl-5-oxo-2,4-dihydro-1,4-benzoxazepin-7-yl)-4-fluoro-benzenesulfonamide CAS Name: 3-chloro-N-(3,3-dimethyl-5-oxo-2,4-dihydro-1,4-benzoxazepin-7-yl)-4-fluorobenzenesulfonamide IUPAC Name: 3-chloro-N-(3,3-dimethyl-5-oxo-2,4-dihydro-1,4-benzoxazepin-7-yl)-4-fluorobenzenesulfonamide Traditional Name: 3-chloro-4-fluoro-N-(5-keto-3,3-dimethyl-2,4-dihydro-1,4-benzoxazepin-7-yl)benzenesulfonamide Formula: C17H16ClFN2O4S MolecularWeight: 398.836343

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)F)Cl)C(=O)N1)C

Isomeric SMILES

CC1(COC2=C(C=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)F)Cl)C(=O)N1)C

InChI

InChI=1S/C17H16ClFN2O4S/c1-17(2)9-25-15-6-3-10(7-12(15)16(22)20-17)21-26(23,24)11-4-5-14(19)13(18)8-11/h3-8,21H,9H2,1-2H3,(H,20,22)