1-bromanyl-N-(3,3,5-trimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)methanesulfonamide

Systemtic Name: 1-bromanyl-N-(3,3,5-trimethyl-4-oxidanylidene-2H-1,5-benzoxazepin-8-yl)methanesulfonamide Openeye Name: 1-bromo-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)methanesulfonamide CAS Name: 1-bromo-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)methanesulfonamide IUPAC Name: 1-bromo-N-(3,3,5-trimethyl-4-oxo-2H-1,5-benzoxazepin-8-yl)methanesulfonamide Traditional Name: 1-bromo-N-(4-keto-3,3,5-trimethyl-2H-1,5-benzoxazepin-8-yl)methanesulfonamide Formula: C13H17BrN2O4S MolecularWeight: 377.25408

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C=CC(=C2)NS(=O)(=O)CBr)N(C1=O)C)C

Isomeric SMILES

CC1(COC2=C(C=CC(=C2)NS(=O)(=O)CBr)N(C1=O)C)C

InChI

InChI=1S/C13H17BrN2O4S/c1-13(2)7-20-11-6-9(15-21(18,19)8-14)4-5-10(11)16(3)12(13)17/h4-6,15H,7-8H2,1-3H3