N-[3-chloranyl-2,6-dinitro-4-(trifluoromethyl)phenyl]-6-fluoranyl-2,5-dimethyl-pyrimidin-4-amine

Systemtic Name: N-[3-chloranyl-2,6-dinitro-4-(trifluoromethyl)phenyl]-6-fluoranyl-2,5-dimethyl-pyrimidin-4-amine Openeye Name: N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-6-fluoro-2,5-dimethyl-pyrimidin-4-amine CAS Name: N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-6-fluoro-2,5-dimethyl-4-pyrimidinamine IUPAC Name: N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-6-fluoro-2,5-dimethylpyrimidin-4-amine Traditional Name: [3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-(6-fluoro-2,5-dimethyl-pyrimidin-4-yl)amine Formula: C13H8ClF4N5O4 MolecularWeight: 409.680333

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=C1F)C)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(N=C(N=C1F)C)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H8ClF4N5O4/c1-4-11(15)19-5(2)20-12(4)21-9-7(22(24)25)3-6(13(16,17)18)8(14)10(9)23(26)27/h3H,1-2H3,(H,19,20,21)