4-[[4-nitro-2-(trifluoromethyl)phenyl]amino]benzenecarbonitrile

Systemtic Name: 4-[[4-nitro-2-(trifluoromethyl)phenyl]amino]benzenecarbonitrile Openeye Name: 4-[4-nitro-2-(trifluoromethyl)anilino]benzonitrile CAS Name: 4-[4-nitro-2-(trifluoromethyl)anilino]benzonitrile IUPAC Name: 4-[4-nitro-2-(trifluoromethyl)anilino]benzonitrile Traditional Name: 4-[4-nitro-2-(trifluoromethyl)anilino]benzonitrile Formula: C14H8F3N3O2 MolecularWeight: 307.22743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H8F3N3O2/c15-14(16,17)12-7-11(20(21)22)5-6-13(12)19-10-3-1-9(8-18)2-4-10/h1-7,19H