N'-(5-nitropyridin-2-yl)-N-[4-nitro-3-(trifluoromethyl)phenyl]ethane-1,2-diamine

Systemtic Name: N'-(5-nitropyridin-2-yl)-N-[4-nitro-3-(trifluoromethyl)phenyl]ethane-1,2-diamine Openeye Name: N'-(5-nitro-2-pyridyl)-N-[4-nitro-3-(trifluoromethyl)phenyl]ethane-1,2-diamine CAS Name: N'-(5-nitro-2-pyridinyl)-N-[4-nitro-3-(trifluoromethyl)phenyl]ethane-1,2-diamine IUPAC Name: N'-(5-nitropyridin-2-yl)-N-[4-nitro-3-(trifluoromethyl)phenyl]ethane-1,2-diamine Traditional Name: (5-nitro-2-pyridyl)-[2-[4-nitro-3-(trifluoromethyl)anilino]ethyl]amine Formula: C14H12F3N5O4 MolecularWeight: 371.27139

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NCCNC2=NC=C(C=C2)[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1NCCNC2=NC=C(C=C2)[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H12F3N5O4/c15-14(16,17)11-7-9(1-3-12(11)22(25)26)18-5-6-19-13-4-2-10(8-20-13)21(23)24/h1-4,7-8,18H,5-6H2,(H,19,20)