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

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2,4-dinitro-6-(trifluoromethyl)aniline Openeye Name: N-(2-bromo-4-methyl-phenyl)-2,4-dinitro-6-(trifluoromethyl)aniline CAS Name: N-(2-bromo-4-methylphenyl)-2,4-dinitro-6-(trifluoromethyl)aniline IUPAC Name: N-(2-bromo-4-methylphenyl)-2,4-dinitro-6-(trifluoromethyl)aniline Traditional Name: (2-bromo-4-methyl-phenyl)-[2,4-dinitro-6-(trifluoromethyl)phenyl]amine Formula: C14H9BrF3N3O4 MolecularWeight: 420.13817

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=C(C=C(C=C2C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-])Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=C(C=C(C=C2C(F)(F)F)[N+](=O)[O-])[N+](=O)[O-])Br

InChI

InChI=1S/C14H9BrF3N3O4/c1-7-2-3-11(10(15)4-7)19-13-9(14(16,17)18)5-8(20(22)23)6-12(13)21(24)25/h2-6,19H,1H3