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

Systemtic Name: 4-bromanyl-N-(3,3-dimethyl-5-oxidanylidene-2,4-dihydro-1,4-benzoxazepin-7-yl)benzenesulfonamide Openeye Name: 4-bromo-N-(3,3-dimethyl-5-oxo-2,4-dihydro-1,4-benzoxazepin-7-yl)benzenesulfonamide CAS Name: 4-bromo-N-(3,3-dimethyl-5-oxo-2,4-dihydro-1,4-benzoxazepin-7-yl)benzenesulfonamide IUPAC Name: 4-bromo-N-(3,3-dimethyl-5-oxo-2,4-dihydro-1,4-benzoxazepin-7-yl)benzenesulfonamide Traditional Name: 4-bromo-N-(5-keto-3,3-dimethyl-2,4-dihydro-1,4-benzoxazepin-7-yl)benzenesulfonamide Formula: C17H17BrN2O4S MolecularWeight: 425.29688

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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)Br)C(=O)N1)C

Isomeric SMILES

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

InChI

InChI=1S/C17H17BrN2O4S/c1-17(2)10-24-15-8-5-12(9-14(15)16(21)19-17)20-25(22,23)13-6-3-11(18)4-7-13/h3-9,20H,10H2,1-2H3,(H,19,21)