3-(4-bromanyl-2-fluoranyl-5-nitro-phenyl)-1,5-dimethyl-6-(trifluoromethyl)pyrimidine-2,4-dione

Systemtic Name: 3-(4-bromanyl-2-fluoranyl-5-nitro-phenyl)-1,5-dimethyl-6-(trifluoromethyl)pyrimidine-2,4-dione Openeye Name: 3-(4-bromo-2-fluoro-5-nitro-phenyl)-1,5-dimethyl-6-(trifluoromethyl)pyrimidine-2,4-dione CAS Name: 3-(4-bromo-2-fluoro-5-nitrophenyl)-1,5-dimethyl-6-(trifluoromethyl)pyrimidine-2,4-dione IUPAC Name: 3-(4-bromo-2-fluoro-5-nitrophenyl)-1,5-dimethyl-6-(trifluoromethyl)pyrimidine-2,4-dione Traditional Name: 3-(4-bromo-2-fluoro-5-nitro-phenyl)-1,5-dimethyl-6-(trifluoromethyl)pyrimidine-2,4-quinone Formula: C13H8BrF4N3O4 MolecularWeight: 426.117933

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=O)N(C1=O)C2=CC(=C(C=C2F)Br)[N+](=O)[O-])C)C(F)(F)F

Isomeric SMILES

CC1=C(N(C(=O)N(C1=O)C2=CC(=C(C=C2F)Br)[N+](=O)[O-])C)C(F)(F)F

InChI

InChI=1S/C13H8BrF4N3O4/c1-5-10(13(16,17)18)19(2)12(23)20(11(5)22)9-4-8(21(24)25)6(14)3-7(9)15/h3-4H,1-2H3