ethyl (4S)-4-ethyl-6-[[2-(4-fluoranylphenoxy)-2-methyl-propanoyl]oxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-4-ethyl-6-[[2-(4-fluoranylphenoxy)-2-methyl-propanoyl]oxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-ethyl-6-[[2-(4-fluorophenoxy)-2-methyl-propanoyl]oxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-ethyl-6-[[2-(4-fluorophenoxy)-2-methyl-1-oxopropoxy]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-ethyl-6-[[2-(4-fluorophenoxy)-2-methylpropanoyl]oxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-ethyl-6-[[2-(4-fluorophenoxy)-2-methyl-propanoyl]oxymethyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H25FN2O6 MolecularWeight: 408.420703

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)COC(=O)C(C)(C)OC2=CC=C(C=C2)F)C(=O)OCC

Isomeric SMILES

CC[C@H]1C(=C(NC(=O)N1)COC(=O)C(C)(C)OC2=CC=C(C=C2)F)C(=O)OCC

InChI

InChI=1S/C20H25FN2O6/c1-5-14-16(17(24)27-6-2)15(23-19(26)22-14)11-28-18(25)20(3,4)29-13-9-7-12(21)8-10-13/h7-10,14H,5-6,11H2,1-4H3,(H2,22,23,26)/t14-/m0/s1