ethyl (4S)-4-ethyl-6-[3-(4-fluorophenyl)propanoyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-4-ethyl-6-[3-(4-fluorophenyl)propanoyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-ethyl-6-[3-(4-fluorophenyl)propanoyloxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-ethyl-6-[[3-(4-fluorophenyl)-1-oxopropoxy]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-ethyl-6-[3-(4-fluorophenyl)propanoyloxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-ethyl-6-[3-(4-fluorophenyl)propanoyloxymethyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C19H23FN2O5 MolecularWeight: 378.394723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)COC(=O)CCC2=CC=C(C=C2)F)C(=O)OCC

Isomeric SMILES

CC[C@H]1C(=C(NC(=O)N1)COC(=O)CCC2=CC=C(C=C2)F)C(=O)OCC

InChI

InChI=1S/C19H23FN2O5/c1-3-14-17(18(24)26-4-2)15(22-19(25)21-14)11-27-16(23)10-7-12-5-8-13(20)9-6-12/h5-6,8-9,14H,3-4,7,10-11H2,1-2H3,(H2,21,22,25)/t14-/m0/s1