ethyl 2-oxidanylidene-6-[(2-oxidanyl-2-phenyl-ethanoyl)oxymethyl]-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-oxidanylidene-6-[(2-oxidanyl-2-phenyl-ethanoyl)oxymethyl]-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(2-hydroxy-2-phenyl-acetyl)oxymethyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[(2-hydroxy-1-oxo-2-phenylethoxy)methyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(2-hydroxy-2-phenylacetyl)oxymethyl]-2-oxo-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-6-(mandeloyloxymethyl)-4-phenyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H22N2O6 MolecularWeight: 410.41988

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)COC(=O)C(C3=CC=CC=C3)O

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CC=C2)COC(=O)C(C3=CC=CC=C3)O

InChI

InChI=1S/C22H22N2O6/c1-2-29-20(26)17-16(13-30-21(27)19(25)15-11-7-4-8-12-15)23-22(28)24-18(17)14-9-5-3-6-10-14/h3-12,18-19,25H,2,13H2,1H3,(H2,23,24,28)