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

Systemtic Name: N-[3-chloranyl-2,6-dinitro-4-(trifluoromethyl)phenyl]-2-ethyl-6-fluoranyl-5-methyl-pyrimidin-4-amine Openeye Name: N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-2-ethyl-6-fluoro-5-methyl-pyrimidin-4-amine CAS Name: N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-2-ethyl-6-fluoro-5-methyl-4-pyrimidinamine IUPAC Name: N-[3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-2-ethyl-6-fluoro-5-methylpyrimidin-4-amine Traditional Name: [3-chloro-2,6-dinitro-4-(trifluoromethyl)phenyl]-(2-ethyl-6-fluoro-5-methyl-pyrimidin-4-yl)amine Formula: C14H10ClF4N5O4 MolecularWeight: 423.706913

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(C(=N1)F)C)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCC1=NC(=C(C(=N1)F)C)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C14H10ClF4N5O4/c1-3-8-20-12(16)5(2)13(21-8)22-10-7(23(25)26)4-6(14(17,18)19)9(15)11(10)24(27)28/h4H,3H2,1-2H3,(H,20,21,22)