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

Systemtic Name: 1-bromanyl-N-(3,3-dimethyl-5-oxidanylidene-2,4-dihydro-1,4-benzoxazepin-7-yl)methanesulfonamide Openeye Name: 1-bromo-N-(3,3-dimethyl-5-oxo-2,4-dihydro-1,4-benzoxazepin-7-yl)methanesulfonamide CAS Name: 1-bromo-N-(3,3-dimethyl-5-oxo-2,4-dihydro-1,4-benzoxazepin-7-yl)methanesulfonamide IUPAC Name: 1-bromo-N-(3,3-dimethyl-5-oxo-2,4-dihydro-1,4-benzoxazepin-7-yl)methanesulfonamide Traditional Name: 1-bromo-N-(5-keto-3,3-dimethyl-2,4-dihydro-1,4-benzoxazepin-7-yl)methanesulfonamide Formula: C12H15BrN2O4S MolecularWeight: 363.2275

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C=C(C=C2)NS(=O)(=O)CBr)C(=O)N1)C

Isomeric SMILES

CC1(COC2=C(C=C(C=C2)NS(=O)(=O)CBr)C(=O)N1)C

InChI

InChI=1S/C12H15BrN2O4S/c1-12(2)6-19-10-4-3-8(15-20(17,18)7-13)5-9(10)11(16)14-12/h3-5,15H,6-7H2,1-2H3,(H,14,16)