ethyl 5-fluoranyl-3-(octanoyloxymethyl)-2,4-bis(oxidanylidene)pyrimidine-1-carboxylate

Systemtic Name: ethyl 5-fluoranyl-3-(octanoyloxymethyl)-2,4-bis(oxidanylidene)pyrimidine-1-carboxylate Openeye Name: ethyl 5-fluoro-3-(octanoyloxymethyl)-2,4-dioxo-pyrimidine-1-carboxylate CAS Name: 5-fluoro-2,4-dioxo-3-(1-oxooctoxymethyl)-1-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-fluoro-3-(octanoyloxymethyl)-2,4-dioxopyrimidine-1-carboxylate Traditional Name: 3-(caprylyloxymethyl)-5-fluoro-2,4-diketo-pyrimidine-1-carboxylic acid ethyl ester Formula: C16H23FN2O6 MolecularWeight: 358.362023

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OCN1C(=O)C(=CN(C1=O)C(=O)OCC)F

Isomeric SMILES

CCCCCCCC(=O)OCN1C(=O)C(=CN(C1=O)C(=O)OCC)F

InChI

InChI=1S/C16H23FN2O6/c1-3-5-6-7-8-9-13(20)25-11-19-14(21)12(17)10-18(15(19)22)16(23)24-4-2/h10H,3-9,11H2,1-2H3