3-(7-fluoranyl-5-isocyanato-4-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl)-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione

Systemtic Name: 3-(7-fluoranyl-5-isocyanato-4-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl)-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione Openeye Name: 3-(7-fluoro-5-isocyanato-4-methyl-3-oxo-1,4-benzoxazin-6-yl)-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione CAS Name: 3-(7-fluoro-5-isocyanato-4-methyl-3-oxo-1,4-benzoxazin-6-yl)-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione IUPAC Name: 3-(7-fluoro-5-isocyanato-4-methyl-3-oxo-1,4-benzoxazin-6-yl)-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-dione Traditional Name: 3-(7-fluoro-5-isocyanato-3-keto-4-methyl-1,4-benzoxazin-6-yl)-1-methyl-6-(trifluoromethyl)pyrimidine-2,4-quinone Formula: C16H10F4N4O5 MolecularWeight: 414.268013

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)COC2=CC(=C(C(=C21)N=C=O)N3C(=O)C=C(N(C3=O)C)C(F)(F)F)F

Isomeric SMILES

CN1C(=O)COC2=CC(=C(C(=C21)N=C=O)N3C(=O)C=C(N(C3=O)C)C(F)(F)F)F

InChI

InChI=1S/C16H10F4N4O5/c1-22-9(16(18,19)20)4-10(26)24(15(22)28)13-7(17)3-8-14(12(13)21-6-25)23(2)11(27)5-29-8/h3-4H,5H2,1-2H3