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

Systemtic Name: ethyl (4S)-6-(2-benzamidoethanoyloxymethyl)-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl (4S)-6-[(2-benzamidoacetyl)oxymethyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-[(2-benzamido-1-oxoethoxy)methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-6-[(2-benzamidoacetyl)oxymethyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-4-ethyl-6-(hippuroyloxymethyl)-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C19H23N3O6 MolecularWeight: 389.40242

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N3O6/c1-3-13-16(18(25)27-4-2)14(22-19(26)21-13)11-28-15(23)10-20-17(24)12-8-6-5-7-9-12/h5-9,13H,3-4,10-11H2,1-2H3,(H,20,24)(H2,21,22,26)/t13-/m0/s1