N-methylsulfonyl-N-[4-nitro-2-[(4-nitrophenyl)methoxy]phenyl]methanesulfonamide

Systemtic Name: N-methylsulfonyl-N-[4-nitro-2-[(4-nitrophenyl)methoxy]phenyl]methanesulfonamide Openeye Name: N-methylsulfonyl-N-[4-nitro-2-[(4-nitrophenyl)methoxy]phenyl]methanesulfonamide CAS Name: N-methylsulfonyl-N-[4-nitro-2-[(4-nitrophenyl)methoxy]phenyl]methanesulfonamide IUPAC Name: N-methylsulfonyl-N-[4-nitro-2-[(4-nitrophenyl)methoxy]phenyl]methanesulfonamide Traditional Name: N-mesyl-N-[4-nitro-2-(4-nitrobenzyl)oxy-phenyl]methanesulfonamide Formula: C15H15N3O9S2 MolecularWeight: 445.4243

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(C1=C(C=C(C=C1)[N+](=O)[O-])OCC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C

Isomeric SMILES

CS(=O)(=O)N(C1=C(C=C(C=C1)[N+](=O)[O-])OCC2=CC=C(C=C2)[N+](=O)[O-])S(=O)(=O)C

InChI

InChI=1S/C15H15N3O9S2/c1-28(23,24)18(29(2,25)26)14-8-7-13(17(21)22)9-15(14)27-10-11-3-5-12(6-4-11)16(19)20/h3-9H,10H2,1-2H3