N-(3-bromanyl-4-iodanyl-phenyl)-2,4-dinitro-6-(trifluoromethyl)aniline

Systemtic Name: N-(3-bromanyl-4-iodanyl-phenyl)-2,4-dinitro-6-(trifluoromethyl)aniline Openeye Name: N-(3-bromo-4-iodo-phenyl)-2,4-dinitro-6-(trifluoromethyl)aniline CAS Name: N-(3-bromo-4-iodophenyl)-2,4-dinitro-6-(trifluoromethyl)aniline IUPAC Name: N-(3-bromo-4-iodophenyl)-2,4-dinitro-6-(trifluoromethyl)aniline Traditional Name: (3-bromo-4-iodo-phenyl)-[2,4-dinitro-6-(trifluoromethyl)phenyl]amine Formula: C13H6BrF3IN3O4 MolecularWeight: 532.00812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=C(C=C(C=C2C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-])Br)I

Isomeric SMILES

C1=CC(=C(C=C1NC2=C(C=C(C=C2C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-])Br)I

InChI

InChI=1S/C13H6BrF3IN3O4/c14-9-3-6(1-2-10(9)18)19-12-8(13(15,16)17)4-7(20(22)23)5-11(12)21(24)25/h1-5,19H