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

Systemtic Name: N-[4-bromanyl-3-(trifluoromethyl)phenyl]-2,4-dinitro-6-(trifluoromethyl)aniline Openeye Name: N-[4-bromo-3-(trifluoromethyl)phenyl]-2,4-dinitro-6-(trifluoromethyl)aniline CAS Name: N-[4-bromo-3-(trifluoromethyl)phenyl]-2,4-dinitro-6-(trifluoromethyl)aniline IUPAC Name: N-[4-bromo-3-(trifluoromethyl)phenyl]-2,4-dinitro-6-(trifluoromethyl)aniline Traditional Name: [4-bromo-3-(trifluoromethyl)phenyl]-[2,4-dinitro-6-(trifluoromethyl)phenyl]amine Formula: C14H6BrF6N3O4 MolecularWeight: 474.109559

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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-])C(F)(F)F)Br

Isomeric SMILES

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

InChI

InChI=1S/C14H6BrF6N3O4/c15-10-2-1-6(3-8(10)13(16,17)18)22-12-9(14(19,20)21)4-7(23(25)26)5-11(12)24(27)28/h1-5,22H