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

Systemtic Name: ethyl 6-[3-(4-cyanophenyl)propanoyloxymethyl]-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[3-(4-cyanophenyl)propanoyloxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[3-(4-cyanophenyl)-1-oxopropoxy]methyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[3-(4-cyanophenyl)propanoyloxymethyl]-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-[3-(4-cyanophenyl)propanoyloxymethyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C18H19N3O5 MolecularWeight: 357.36056

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1)COC(=O)CCC2=CC=C(C=C2)C#N

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1)COC(=O)CCC2=CC=C(C=C2)C#N

InChI

InChI=1S/C18H19N3O5/c1-2-25-17(23)14-10-20-18(24)21-15(14)11-26-16(22)8-7-12-3-5-13(9-19)6-4-12/h3-6H,2,7-8,10-11H2,1H3,(H2,20,21,24)