ethyl 3-ethanoyl-6-methyl-2-oxidanylidene-4-(3-phenoxyphenyl)-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 3-ethanoyl-6-methyl-2-oxidanylidene-4-(3-phenoxyphenyl)-1,4-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-acetyl-6-methyl-2-oxo-4-(3-phenoxyphenyl)-1,4-dihydropyrimidine-5-carboxylate CAS Name: 3-acetyl-6-methyl-2-oxo-4-(3-phenoxyphenyl)-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-acetyl-6-methyl-2-oxo-4-(3-phenoxyphenyl)-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 3-acetyl-2-keto-6-methyl-4-(3-phenoxyphenyl)-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)N(C1C2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N(C1C2=CC(=CC=C2)OC3=CC=CC=C3)C(=O)C)C

InChI

InChI=1S/C22H22N2O5/c1-4-28-21(26)19-14(2)23-22(27)24(15(3)25)20(19)16-9-8-12-18(13-16)29-17-10-6-5-7-11-17/h5-13,20H,4H2,1-3H3,(H,23,27)