N-[2,6-bis(bromanyl)-4-nitro-phenyl]-N-methyl-2,4-dinitro-6-(trifluoromethyl)aniline

Systemtic Name: N-[2,6-bis(bromanyl)-4-nitro-phenyl]-N-methyl-2,4-dinitro-6-(trifluoromethyl)aniline Openeye Name: N-(2,6-dibromo-4-nitro-phenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)aniline CAS Name: N-(2,6-dibromo-4-nitrophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)aniline IUPAC Name: N-(2,6-dibromo-4-nitrophenyl)-N-methyl-2,4-dinitro-6-(trifluoromethyl)aniline Traditional Name: (2,6-dibromo-4-nitro-phenyl)-[2,4-dinitro-6-(trifluoromethyl)phenyl]-methyl-amine Formula: C14H7Br2F3N4O6 MolecularWeight: 544.03179

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=C(C=C(C=C1C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-])C2=C(C=C(C=C2Br)[N+](=O)[O-])Br

Isomeric SMILES

CN(C1=C(C=C(C=C1C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-])C2=C(C=C(C=C2Br)[N+](=O)[O-])Br

InChI

InChI=1S/C14H7Br2F3N4O6/c1-20(13-9(15)3-7(22(26)27)4-10(13)16)12-8(14(17,18)19)2-6(21(24)25)5-11(12)23(28)29/h2-5H,1H3