N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-1-(2-nitrophenyl)methanesulfonamide

Systemtic Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-1-(2-nitrophenyl)methanesulfonamide Openeye Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-1-(2-nitrophenyl)methanesulfonamide CAS Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-1-(2-nitrophenyl)methanesulfonamide IUPAC Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-1-(2-nitrophenyl)methanesulfonamide Traditional Name: N-[3,5-dimethyl-4-(nitromethylsulfonyl)phenyl]-1-(2-nitrophenyl)methanesulfonamide Formula: C16H17N3O8S2 MolecularWeight: 443.45148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1S(=O)(=O)C[N+](=O)[O-])C)NS(=O)(=O)CC2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1S(=O)(=O)C[N+](=O)[O-])C)NS(=O)(=O)CC2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O8S2/c1-11-7-14(8-12(2)16(11)28(24,25)10-18(20)21)17-29(26,27)9-13-5-3-4-6-15(13)19(22)23/h3-8,17H,9-10H2,1-2H3