3-(7-fluoranyl-3-oxidanylidene-4-prop-2-ynyl-1,4-benzoxazin-6-yl)-6-oxidanyl-6-(trifluoromethyl)-1,3-diazinane-2,4-dione

Systemtic Name: 3-(7-fluoranyl-3-oxidanylidene-4-prop-2-ynyl-1,4-benzoxazin-6-yl)-6-oxidanyl-6-(trifluoromethyl)-1,3-diazinane-2,4-dione Openeye Name: 3-(7-fluoro-3-oxo-4-prop-2-ynyl-1,4-benzoxazin-6-yl)-6-hydroxy-6-(trifluoromethyl)hexahydropyrimidine-2,4-dione CAS Name: 3-(7-fluoro-3-oxo-4-prop-2-ynyl-1,4-benzoxazin-6-yl)-6-hydroxy-6-(trifluoromethyl)-1,3-diazinane-2,4-dione IUPAC Name: 3-(7-fluoro-3-oxo-4-prop-2-ynyl-1,4-benzoxazin-6-yl)-6-hydroxy-6-(trifluoromethyl)-1,3-diazinane-2,4-dione Traditional Name: 3-(7-fluoro-3-keto-4-propargyl-1,4-benzoxazin-6-yl)-6-hydroxy-6-(trifluoromethyl)-5,6-dihydrouracil Formula: C16H11F4N3O5 MolecularWeight: 401.269253

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C(=O)COC2=CC(=C(C=C21)N3C(=O)CC(NC3=O)(C(F)(F)F)O)F

Isomeric SMILES

C#CCN1C(=O)COC2=CC(=C(C=C21)N3C(=O)CC(NC3=O)(C(F)(F)F)O)F

InChI

InChI=1S/C16H11F4N3O5/c1-2-3-22-10-5-9(8(17)4-11(10)28-7-13(22)25)23-12(24)6-15(27,16(18,19)20)21-14(23)26/h1,4-5,27H,3,6-7H2,(H,21,26)