N2-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N1-(5-nitroquinolin-8-yl)propane-1,2-diamine

Systemtic Name: N2-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N1-(5-nitroquinolin-8-yl)propane-1,2-diamine Openeye Name: N2-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N1-(5-nitro-8-quinolyl)propane-1,2-diamine CAS Name: N2-[2,6-dinitro-4-(trifluoromethyl)phenyl]-N1-(5-nitro-8-quinolinyl)propane-1,2-diamine IUPAC Name: 2-N-[2,6-dinitro-4-(trifluoromethyl)phenyl]-1-N-(5-nitroquinolin-8-yl)propane-1,2-diamine Traditional Name: 2-[2,6-dinitro-4-(trifluoromethyl)anilino]propyl-(5-nitro-8-quinolyl)amine Formula: C19H15F3N6O6 MolecularWeight: 480.35421

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=C2C(=C(C=C1)[N+](=O)[O-])C=CC=N2)NC3=C(C=C(C=C3[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC(CNC1=C2C(=C(C=C1)[N+](=O)[O-])C=CC=N2)NC3=C(C=C(C=C3[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H15F3N6O6/c1-10(9-24-13-4-5-14(26(29)30)12-3-2-6-23-17(12)13)25-18-15(27(31)32)7-11(19(20,21)22)8-16(18)28(33)34/h2-8,10,24-25H,9H2,1H3