N-(4-bromanyl-2-nitro-phenyl)-2,4-dinitro-6-(trifluoromethyl)aniline

Systemtic Name: N-(4-bromanyl-2-nitro-phenyl)-2,4-dinitro-6-(trifluoromethyl)aniline Openeye Name: N-(4-bromo-2-nitro-phenyl)-2,4-dinitro-6-(trifluoromethyl)aniline CAS Name: N-(4-bromo-2-nitrophenyl)-2,4-dinitro-6-(trifluoromethyl)aniline IUPAC Name: N-(4-bromo-2-nitrophenyl)-2,4-dinitro-6-(trifluoromethyl)aniline Traditional Name: (4-bromo-2-nitro-phenyl)-[2,4-dinitro-6-(trifluoromethyl)phenyl]amine Formula: C13H6BrF3N4O6 MolecularWeight: 451.10915

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)[N+](=O)[O-])NC2=C(C=C(C=C2C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1Br)[N+](=O)[O-])NC2=C(C=C(C=C2C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H6BrF3N4O6/c14-6-1-2-9(10(3-6)20(24)25)18-12-8(13(15,16)17)4-7(19(22)23)5-11(12)21(26)27/h1-5,18H