4-bromanyl-N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-2,5-bis(fluoranyl)benzenesulfonamide

Systemtic Name: 4-bromanyl-N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-2,5-bis(fluoranyl)benzenesulfonamide Openeye Name: 4-bromo-N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-2,5-difluoro-benzenesulfonamide CAS Name: 4-bromo-N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-2,5-difluorobenzenesulfonamide IUPAC Name: 4-bromo-N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-2,5-difluorobenzenesulfonamide Traditional Name: 4-bromo-N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-2,5-difluoro-benzenesulfonamide Formula: C15H13BrF2N2O6S2 MolecularWeight: 499.304326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)C[N+](=O)[O-])C)NS(=O)(=O)C2=C(C=C(C(=C2)F)Br)F

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)C[N+](=O)[O-])C)NS(=O)(=O)C2=C(C=C(C(=C2)F)Br)F

InChI

InChI=1S/C15H13BrF2N2O6S2/c1-8-3-10(4-9(2)15(8)27(23,24)7-20(21)22)19-28(25,26)14-6-12(17)11(16)5-13(14)18/h3-6,19H,7H2,1-2H3