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

Systemtic Name: N-methyl-2,6-dinitro-4-(trifluoromethyl)aniline Openeye Name: N-methyl-2,6-dinitro-4-(trifluoromethyl)aniline CAS Name: N-methyl-2,6-dinitro-4-(trifluoromethyl)aniline IUPAC Name: N-methyl-2,6-dinitro-4-(trifluoromethyl)aniline Traditional Name: [2,6-dinitro-4-(trifluoromethyl)phenyl]-methyl-amine Formula: C8H6F3N3O4 MolecularWeight: 265.14615

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C8H6F3N3O4/c1-12-7-5(13(15)16)2-4(8(9,10)11)3-6(7)14(17)18/h2-3,12H,1H3