3-azido-N-ethyl-N-(2-methylprop-2-enyl)-2,6-dinitro-4-(trifluoromethyl)aniline

Systemtic Name: 3-azido-N-ethyl-N-(2-methylprop-2-enyl)-2,6-dinitro-4-(trifluoromethyl)aniline Openeye Name: 3-azido-N-ethyl-N-(2-methylallyl)-2,6-dinitro-4-(trifluoromethyl)aniline CAS Name: 3-azido-N-ethyl-N-(2-methylprop-2-enyl)-2,6-dinitro-4-(trifluoromethyl)aniline IUPAC Name: 3-azido-N-ethyl-N-(2-methylprop-2-enyl)-2,6-dinitro-4-(trifluoromethyl)aniline Traditional Name: [3-azido-2,6-dinitro-4-(trifluoromethyl)phenyl]-ethyl-(2-methylallyl)amine Formula: C13H13F3N6O4 MolecularWeight: 374.27533

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13F3N6O4/c1-4-20(6-7(2)3)11-9(21(23)24)5-8(13(14,15)16)10(18-19-17)12(11)22(25)26/h5H,2,4,6H2,1,3H3