ethyl 5-cyano-4-(3-methoxyphenyl)-6-methyl-2-oxidanylidene-1,4-dihydropyrimidine-3-carboxylate

Systemtic Name: ethyl 5-cyano-4-(3-methoxyphenyl)-6-methyl-2-oxidanylidene-1,4-dihydropyrimidine-3-carboxylate Openeye Name: ethyl 5-cyano-4-(3-methoxyphenyl)-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxylate CAS Name: 5-cyano-4-(3-methoxyphenyl)-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-4-(3-methoxyphenyl)-6-methyl-2-oxo-1,4-dihydropyrimidine-3-carboxylate Traditional Name: 5-cyano-2-keto-4-(3-methoxyphenyl)-6-methyl-1,4-dihydropyrimidine-3-carboxylic acid ethyl ester Formula: C16H17N3O4 MolecularWeight: 315.32388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(C(=C(NC1=O)C)C#N)C2=CC(=CC=C2)OC

Isomeric SMILES

CCOC(=O)N1C(C(=C(NC1=O)C)C#N)C2=CC(=CC=C2)OC

InChI

InChI=1S/C16H17N3O4/c1-4-23-16(21)19-14(11-6-5-7-12(8-11)22-3)13(9-17)10(2)18-15(19)20/h5-8,14H,4H2,1-3H3,(H,18,20)