N-[2-nitro-4-(trifluoromethyl)phenyl]-3H-benzimidazol-5-amine

Systemtic Name: N-[2-nitro-4-(trifluoromethyl)phenyl]-3H-benzimidazol-5-amine Openeye Name: N-[2-nitro-4-(trifluoromethyl)phenyl]-3H-benzimidazol-5-amine CAS Name: N-[2-nitro-4-(trifluoromethyl)phenyl]-3H-benzimidazol-5-amine IUPAC Name: N-[2-nitro-4-(trifluoromethyl)phenyl]-3H-benzimidazol-5-amine Traditional Name: 3H-benzimidazol-5-yl-[2-nitro-4-(trifluoromethyl)phenyl]amine Formula: C14H9F3N4O2 MolecularWeight: 322.24207

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])NC2=CC3=C(C=C2)N=CN3

Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])NC2=CC3=C(C=C2)N=CN3

InChI

InChI=1S/C14H9F3N4O2/c15-14(16,17)8-1-3-11(13(5-8)21(22)23)20-9-2-4-10-12(6-9)19-7-18-10/h1-7,20H,(H,18,19)