3,3-dimethylbutan-2-yl 4-[3-(hydroxymethyl)-5-methoxy-4-oxidanyl-phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: 3,3-dimethylbutan-2-yl 4-[3-(hydroxymethyl)-5-methoxy-4-oxidanyl-phenyl]-6-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 1,2,2-trimethylpropyl 4-[4-hydroxy-3-(hydroxymethyl)-5-methoxy-phenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-[4-hydroxy-3-(hydroxymethyl)-5-methoxyphenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 3,3-dimethylbutan-2-yl ester IUPAC Name: 3,3-dimethylbutan-2-yl 4-[4-hydroxy-3-(hydroxymethyl)-5-methoxyphenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(4-hydroxy-3-methoxy-5-methylol-phenyl)-2-keto-6-methyl-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 1,2,2-trimethylpropyl ester Formula: C20H28N2O6 MolecularWeight: 392.44612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1)C2=CC(=C(C(=C2)OC)O)CO)C(=O)OC(C)C(C)(C)C

Isomeric SMILES

CC1=C(C(NC(=O)N1)C2=CC(=C(C(=C2)OC)O)CO)C(=O)OC(C)C(C)(C)C

InChI

InChI=1S/C20H28N2O6/c1-10-15(18(25)28-11(2)20(3,4)5)16(22-19(26)21-10)12-7-13(9-23)17(24)14(8-12)27-6/h7-8,11,16,23-24H,9H2,1-6H3,(H2,21,22,26)