methyl 3,4-dimethyl-2-oxidanylidene-6-(3-phenylmethoxyphenyl)-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 3,4-dimethyl-2-oxidanylidene-6-(3-phenylmethoxyphenyl)-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl 6-(3-benzyloxyphenyl)-3,4-dimethyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3,4-dimethyl-2-oxo-6-(3-phenylmethoxyphenyl)-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 3,4-dimethyl-2-oxo-6-(3-phenylmethoxyphenyl)-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(3-benzoxyphenyl)-2-keto-3,4-dimethyl-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1C)C2=CC(=CC=C2)OCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=C(C(NC(=O)N1C)C2=CC(=CC=C2)OCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C21H22N2O4/c1-14-18(20(24)26-3)19(22-21(25)23(14)2)16-10-7-11-17(12-16)27-13-15-8-5-4-6-9-15/h4-12,19H,13H2,1-3H3,(H,22,25)