ethyl (4S)-4-ethyl-6-[(2-fluoranyl-4-methoxy-phenyl)carbonyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-4-ethyl-6-[(2-fluoranyl-4-methoxy-phenyl)carbonyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-ethyl-6-[(2-fluoro-4-methoxy-benzoyl)oxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-ethyl-6-[[(2-fluoro-4-methoxyphenyl)-oxomethoxy]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-ethyl-6-[(2-fluoro-4-methoxybenzoyl)oxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-ethyl-6-[(2-fluoro-4-methoxy-benzoyl)oxymethyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H21FN2O6 MolecularWeight: 380.367543

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)COC(=O)C2=C(C=C(C=C2)OC)F)C(=O)OCC

Isomeric SMILES

CC[C@H]1C(=C(NC(=O)N1)COC(=O)C2=C(C=C(C=C2)OC)F)C(=O)OCC

InChI

InChI=1S/C18H21FN2O6/c1-4-13-15(17(23)26-5-2)14(21-18(24)20-13)9-27-16(22)11-7-6-10(25-3)8-12(11)19/h6-8,13H,4-5,9H2,1-3H3,(H2,20,21,24)/t13-/m0/s1