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

Systemtic Name: pentyl 2-[2-(hydroxymethyl)-4-oxidanylidene-6-phenyl-1H-pyrimidin-5-yl]propanoate Openeye Name: pentyl 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 pentyl ester IUPAC Name: pentyl 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 amyl ester Formula: C19H24N2O4 MolecularWeight: 344.40486

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N2O4/c1-3-4-8-11-25-19(24)13(2)16-17(14-9-6-5-7-10-14)20-15(12-22)21-18(16)23/h5-7,9-10,13,22H,3-4,8,11-12H2,1-2H3,(H,20,21,23)