N,N-diethyl-3-nitro-4-[2-nitro-4-(trifluoromethyl)phenoxy]benzenesulfonamide

Systemtic Name: N,N-diethyl-3-nitro-4-[2-nitro-4-(trifluoromethyl)phenoxy]benzenesulfonamide Openeye Name: N,N-diethyl-3-nitro-4-[2-nitro-4-(trifluoromethyl)phenoxy]benzenesulfonamide CAS Name: N,N-diethyl-3-nitro-4-[2-nitro-4-(trifluoromethyl)phenoxy]benzenesulfonamide IUPAC Name: N,N-diethyl-3-nitro-4-[2-nitro-4-(trifluoromethyl)phenoxy]benzenesulfonamide Traditional Name: N,N-diethyl-3-nitro-4-[2-nitro-4-(trifluoromethyl)phenoxy]benzenesulfonamide Formula: C17H16F3N3O7S MolecularWeight: 463.38505

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H16F3N3O7S/c1-3-21(4-2)31(28,29)12-6-8-16(14(10-12)23(26)27)30-15-7-5-11(17(18,19)20)9-13(15)22(24)25/h5-10H,3-4H2,1-2H3