2-methylpropyl 2-[2-(hydroxymethyl)-4-oxidanylidene-6-phenyl-1H-pyrimidin-5-yl]propanoate

Systemtic Name: 2-methylpropyl 2-[2-(hydroxymethyl)-4-oxidanylidene-6-phenyl-1H-pyrimidin-5-yl]propanoate Openeye Name: isobutyl 2-[2-(hydroxymethyl)-4-oxo-6-phenyl-1H-pyrimidin-5-yl]propanoate CAS Name: 2-[2-(hydroxymethyl)-4-oxo-6-phenyl-1H-pyrimidin-5-yl]propanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[2-(hydroxymethyl)-4-oxo-6-phenyl-1H-pyrimidin-5-yl]propanoate Traditional Name: 2-(4-keto-2-methylol-6-phenyl-1H-pyrimidin-5-yl)propionic acid isobutyl ester Formula: C18H22N2O4 MolecularWeight: 330.37828

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C(C)C1=C(NC(=NC1=O)CO)C2=CC=CC=C2

Isomeric SMILES

CC(C)COC(=O)C(C)C1=C(NC(=NC1=O)CO)C2=CC=CC=C2

InChI

InChI=1S/C18H22N2O4/c1-11(2)10-24-18(23)12(3)15-16(13-7-5-4-6-8-13)19-14(9-21)20-17(15)22/h4-8,11-12,21H,9-10H2,1-3H3,(H,19,20,22)