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

Systemtic Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-4-(trifluoromethyloxy)benzenesulfonamide Openeye Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-4-(trifluoromethoxy)benzenesulfonamide CAS Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-4-(trifluoromethoxy)benzenesulfonamide IUPAC Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-4-(trifluoromethoxy)benzenesulfonamide Traditional Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-4-(trifluoromethoxy)benzenesulfonamide Formula: C16H15F3N2O7S2 MolecularWeight: 468.42471

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=C(C=C2)OC(F)(F)F

Isomeric SMILES

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

InChI

InChI=1S/C16H15F3N2O7S2/c1-10-7-12(8-11(2)15(10)29(24,25)9-21(22)23)20-30(26,27)14-5-3-13(4-6-14)28-16(17,18)19/h3-8,20H,9H2,1-2H3