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

Systemtic Name: ethyl 2-[2-(hydroxymethyl)-4-oxidanylidene-6-phenyl-1H-pyrimidin-5-yl]propanoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N2O4/c1-3-22-16(21)10(2)13-14(11-7-5-4-6-8-11)17-12(9-19)18-15(13)20/h4-8,10,19H,3,9H2,1-2H3,(H,17,18,20)