ethyl 4-(4-methoxycarbonylphenyl)-6-methyl-2-phenyl-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(4-methoxycarbonylphenyl)-6-methyl-2-phenyl-1,4-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 4-(4-methoxycarbonylphenyl)-6-methyl-2-phenyl-1,4-dihydropyrimidine-5-carboxylate CAS Name: 4-(4-methoxycarbonylphenyl)-6-methyl-2-phenyl-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methoxycarbonylphenyl)-6-methyl-2-phenyl-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 4-(4-carbomethoxyphenyl)-6-methyl-2-phenyl-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N2O4/c1-4-28-22(26)18-14(2)23-20(16-8-6-5-7-9-16)24-19(18)15-10-12-17(13-11-15)21(25)27-3/h5-13,19H,4H2,1-3H3,(H,23,24)