[5-ethoxycarbonyl-5-fluoranyl-2,6-bis(oxidanylidene)-1,3-diazinan-4-yl]oxy-phenyl-propan-2-ylidene-azanium

Systemtic Name: [5-ethoxycarbonyl-5-fluoranyl-2,6-bis(oxidanylidene)-1,3-diazinan-4-yl]oxy-phenyl-propan-2-ylidene-azanium Openeye Name: (5-ethoxycarbonyl-5-fluoro-2,6-dioxo-hexahydropyrimidin-4-yl)oxy-isopropylidene-phenyl-ammonium CAS Name: (5-ethoxycarbonyl-5-fluoro-2,6-dioxo-1,3-diazinan-4-yl)oxy-phenyl-propan-2-ylideneammonium IUPAC Name: (5-ethoxycarbonyl-5-fluoro-2,6-dioxo-1,3-diazinan-4-yl)oxy-phenyl-propan-2-ylideneazanium Traditional Name: (5-carbethoxy-5-fluoro-2,6-diketo-hexahydropyrimidin-4-yl)oxy-isopropylidene-phenyl-ammonium Formula: C16H19FN3O5+ MolecularWeight: 352.337563

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(NC(=O)NC1=O)O[N+](=C(C)C)C2=CC=CC=C2)F

Isomeric SMILES

CCOC(=O)C1(C(NC(=O)NC1=O)O[N+](=C(C)C)C2=CC=CC=C2)F

InChI

InChI=1S/C16H18FN3O5/c1-4-24-14(22)16(17)12(21)18-15(23)19-13(16)25-20(10(2)3)11-8-6-5-7-9-11/h5-9,13H,4H2,1-3H3,(H-,18,19,21,23)/p+1