pentyl 3-[2-(hydroxymethyl)-4-oxidanylidene-6-phenyl-1H-pyrimidin-5-yl]propanoate

Systemtic Name: pentyl 3-[2-(hydroxymethyl)-4-oxidanylidene-6-phenyl-1H-pyrimidin-5-yl]propanoate Openeye Name: pentyl 3-[2-(hydroxymethyl)-4-oxo-6-phenyl-1H-pyrimidin-5-yl]propanoate CAS Name: 3-[2-(hydroxymethyl)-4-oxo-6-phenyl-1H-pyrimidin-5-yl]propanoic acid pentyl ester IUPAC Name: pentyl 3-[2-(hydroxymethyl)-4-oxo-6-phenyl-1H-pyrimidin-5-yl]propanoate Traditional Name: 3-(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)CCC1=C(NC(=NC1=O)CO)C2=CC=CC=C2

Isomeric SMILES

CCCCCOC(=O)CCC1=C(NC(=NC1=O)CO)C2=CC=CC=C2

InChI

InChI=1S/C19H24N2O4/c1-2-3-7-12-25-17(23)11-10-15-18(14-8-5-4-6-9-14)20-16(13-22)21-19(15)24/h4-6,8-9,22H,2-3,7,10-13H2,1H3,(H,20,21,24)