2,6-dinitro-N-phenethyl-4-(trifluoromethyl)aniline

Systemtic Name: 2,6-dinitro-N-phenethyl-4-(trifluoromethyl)aniline Openeye Name: 2,6-dinitro-N-phenethyl-4-(trifluoromethyl)aniline CAS Name: 2,6-dinitro-N-phenethyl-4-(trifluoromethyl)aniline IUPAC Name: 2,6-dinitro-N-phenethyl-4-(trifluoromethyl)aniline Traditional Name: [2,6-dinitro-4-(trifluoromethyl)phenyl]-phenethyl-amine Formula: C15H12F3N3O4 MolecularWeight: 355.26869

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=C(C=C(C=C2[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C15H12F3N3O4/c16-15(17,18)11-8-12(20(22)23)14(13(9-11)21(24)25)19-7-6-10-4-2-1-3-5-10/h1-5,8-9,19H,6-7H2