2-[[3-chloranyl-2,6-dinitro-4-(trifluoromethyl)phenyl]amino]benzenecarbonitrile

Systemtic Name: 2-[[3-chloranyl-2,6-dinitro-4-(trifluoromethyl)phenyl]amino]benzenecarbonitrile Openeye Name: 2-[3-chloro-2,6-dinitro-4-(trifluoromethyl)anilino]benzonitrile CAS Name: 2-[3-chloro-2,6-dinitro-4-(trifluoromethyl)anilino]benzonitrile IUPAC Name: 2-[3-chloro-2,6-dinitro-4-(trifluoromethyl)anilino]benzonitrile Traditional Name: 2-[3-chloro-2,6-dinitro-4-(trifluoromethyl)anilino]benzonitrile Formula: C14H6ClF3N4O4 MolecularWeight: 386.67005

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H6ClF3N4O4/c15-11-8(14(16,17)18)5-10(21(23)24)12(13(11)22(25)26)20-9-4-2-1-3-7(9)6-19/h1-5,20H