ethyl (4S)-4-ethyl-2-oxidanylidene-6-(pyridin-3-ylcarbonyloxymethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl (4S)-4-ethyl-2-oxidanylidene-6-(pyridin-3-ylcarbonyloxymethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-4-ethyl-2-oxo-6-(pyridine-3-carbonyloxymethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-4-ethyl-2-oxo-6-[[oxo(3-pyridinyl)methoxy]methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-ethyl-2-oxo-6-(pyridine-3-carbonyloxymethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-ethyl-2-keto-6-(nicotinoyloxymethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C16H19N3O5 MolecularWeight: 333.33916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N3O5/c1-3-11-13(15(21)23-4-2)12(19-16(22)18-11)9-24-14(20)10-6-5-7-17-8-10/h5-8,11H,3-4,9H2,1-2H3,(H2,18,19,22)/t11-/m0/s1