N,N'-bis[2-nitro-4-(trifluoromethyl)phenyl]hexane-1,6-diamine

Systemtic Name: N,N'-bis[2-nitro-4-(trifluoromethyl)phenyl]hexane-1,6-diamine Openeye Name: N,N'-bis[2-nitro-4-(trifluoromethyl)phenyl]hexane-1,6-diamine CAS Name: N,N'-bis[2-nitro-4-(trifluoromethyl)phenyl]hexane-1,6-diamine IUPAC Name: N,N'-bis[2-nitro-4-(trifluoromethyl)phenyl]hexane-1,6-diamine Traditional Name: 6-[2-nitro-4-(trifluoromethyl)anilino]hexyl-[2-nitro-4-(trifluoromethyl)phenyl]amine Formula: C20H20F6N4O4 MolecularWeight: 494.387619

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])NCCCCCCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])NCCCCCCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C20H20F6N4O4/c21-19(22,23)13-5-7-15(17(11-13)29(31)32)27-9-3-1-2-4-10-28-16-8-6-14(20(24,25)26)12-18(16)30(33)34/h5-8,11-12,27-28H,1-4,9-10H2