1-[3-chloranyl-2,6-dinitro-4-(trifluoromethyl)phenyl]-6-fluoranyl-2H-pyrimidin-4-amine

Systemtic Name: 1-[3-chloranyl-2,6-dinitro-4-(trifluoromethyl)phenyl]-6-fluoranyl-2H-pyrimidin-4-amine Openeye Name: 1-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-6-fluoro-2H-pyrimidin-4-amine CAS Name: 1-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-6-fluoro-2H-pyrimidin-4-amine IUPAC Name: 1-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-6-fluoro-2H-pyrimidin-4-amine Traditional Name: [1-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-6-fluoro-2H-pyrimidin-4-yl]amine Formula: C11H6ClF4N5O4 MolecularWeight: 383.643053

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Descriptors Computed from Structure

Canonical SMILES:

C1N=C(C=C(N1C2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])F)N

Isomeric SMILES

C1N=C(C=C(N1C2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])F)N

InChI

InChI=1S/C11H6ClF4N5O4/c12-8-4(11(14,15)16)1-5(20(22)23)9(10(8)21(24)25)19-3-18-7(17)2-6(19)13/h1-2H,3H2,(H2,17,18)