2-bromanyl-7-[[3-(2-chloranyl-5-nitro-phenyl)-1,2-oxaziridin-2-yl]sulfonylmethyl]-4,7-dimethyl-bicyclo[2.2.1]heptan-3-one

Systemtic Name: 2-bromanyl-7-[[3-(2-chloranyl-5-nitro-phenyl)-1,2-oxaziridin-2-yl]sulfonylmethyl]-4,7-dimethyl-bicyclo[2.2.1]heptan-3-one Openeye Name: 3-bromo-7-[[3-(2-chloro-5-nitro-phenyl)oxaziridin-2-yl]sulfonylmethyl]-1,7-dimethyl-norbornan-2-one CAS Name: 2-bromo-7-[[3-(2-chloro-5-nitrophenyl)-2-oxaziridinyl]sulfonylmethyl]-4,7-dimethyl-3-bicyclo[2.2.1]heptanone IUPAC Name: 2-bromo-7-[[3-(2-chloro-5-nitrophenyl)oxaziridin-2-yl]sulfonylmethyl]-4,7-dimethylbicyclo[2.2.1]heptan-3-one Traditional Name: 3-bromo-7-[[3-(2-chloro-5-nitro-phenyl)oxaziridin-2-yl]sulfonylmethyl]-1,7-dimethyl-norbornan-2-one Formula: C17H18BrClN2O6S MolecularWeight: 493.75662

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC(C1(C)CS(=O)(=O)N3C(O3)C4=C(C=CC(=C4)[N+](=O)[O-])Cl)C(C2=O)Br

Isomeric SMILES

CC12CCC(C1(C)CS(=O)(=O)N3C(O3)C4=C(C=CC(=C4)[N+](=O)[O-])Cl)C(C2=O)Br

InChI

InChI=1S/C17H18BrClN2O6S/c1-16-6-5-11(13(18)14(16)22)17(16,2)8-28(25,26)21-15(27-21)10-7-9(20(23)24)3-4-12(10)19/h3-4,7,11,13,15H,5-6,8H2,1-2H3