3-(2-azanyl-3-nitro-phenyl)-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione

Systemtic Name: 3-(2-azanyl-3-nitro-phenyl)-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione Openeye Name: 3-(2-amino-3-nitro-phenyl)-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione CAS Name: 3-(2-amino-3-nitrophenyl)-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione IUPAC Name: 3-(2-amino-3-nitrophenyl)-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione Traditional Name: 3-(2-amino-3-nitro-phenyl)-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-quinone Formula: C12H9F3N4O4 MolecularWeight: 330.21947

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C2=C(C(=CC=C2)[N+](=O)[O-])N)C(F)(F)F

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C2=C(C(=CC=C2)[N+](=O)[O-])N)C(F)(F)F

InChI

InChI=1S/C12H9F3N4O4/c1-17-8(12(13,14)15)5-9(20)18(11(17)21)6-3-2-4-7(10(6)16)19(22)23/h2-5H,16H2,1H3