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

Systemtic Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-3,5-bis(fluoranyl)benzenesulfonamide Openeye Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-3,5-difluoro-benzenesulfonamide CAS Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-3,5-difluorobenzenesulfonamide IUPAC Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-3,5-difluorobenzenesulfonamide Traditional Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-3,5-difluoro-benzenesulfonamide Formula: C15H14F2N2O6S2 MolecularWeight: 420.408266

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14F2N2O6S2/c1-9-3-13(4-10(2)15(9)26(22,23)8-19(20)21)18-27(24,25)14-6-11(16)5-12(17)7-14/h3-7,18H,8H2,1-2H3