2-methylpropyl 6-[3,4-bis(oxidanyl)phenyl]-4-methyl-2-oxidanylidene-3-(phenylmethyl)-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: 2-methylpropyl 6-[3,4-bis(oxidanyl)phenyl]-4-methyl-2-oxidanylidene-3-(phenylmethyl)-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isobutyl 3-benzyl-6-(3,4-dihydroxyphenyl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(3,4-dihydroxyphenyl)-4-methyl-2-oxo-3-(phenylmethyl)-1,6-dihydropyrimidine-5-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-benzyl-6-(3,4-dihydroxyphenyl)-4-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-benzyl-6-(3,4-dihydroxyphenyl)-2-keto-4-methyl-1,6-dihydropyrimidine-5-carboxylic acid isobutyl ester Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1CC2=CC=CC=C2)C3=CC(=C(C=C3)O)O)C(=O)OCC(C)C

Isomeric SMILES

CC1=C(C(NC(=O)N1CC2=CC=CC=C2)C3=CC(=C(C=C3)O)O)C(=O)OCC(C)C

InChI

InChI=1S/C23H26N2O5/c1-14(2)13-30-22(28)20-15(3)25(12-16-7-5-4-6-8-16)23(29)24-21(20)17-9-10-18(26)19(27)11-17/h4-11,14,21,26-27H,12-13H2,1-3H3,(H,24,29)