4-bromanyl-N-(5-ethyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide

Systemtic Name: 4-bromanyl-N-(5-ethyl-6-oxidanylidene-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide Openeye Name: 4-bromo-N-(5-ethyl-6-oxo-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide CAS Name: 4-bromo-N-(5-ethyl-6-oxo-8-benzo[b][1,4]benzoxazepinyl)benzenesulfonamide IUPAC Name: 4-bromo-N-(5-ethyl-6-oxobenzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide Traditional Name: 4-bromo-N-(5-ethyl-6-keto-benzo[b][1,4]benzoxazepin-8-yl)benzenesulfonamide Formula: C21H17BrN2O4S MolecularWeight: 473.33968

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2OC3=C(C1=O)C=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCN1C2=CC=CC=C2OC3=C(C1=O)C=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H17BrN2O4S/c1-2-24-18-5-3-4-6-20(18)28-19-12-9-15(13-17(19)21(24)25)23-29(26,27)16-10-7-14(22)8-11-16/h3-13,23H,2H2,1H3