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

Systemtic Name: pentyl 2-[4-oxidanyl-6-oxidanylidene-2-(phenylmethyl)-1H-pyrimidin-5-yl]propanoate Openeye Name: pentyl 2-(2-benzyl-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)propanoate CAS Name: 2-[4-hydroxy-6-oxo-2-(phenylmethyl)-1H-pyrimidin-5-yl]propanoic acid pentyl ester IUPAC Name: pentyl 2-(2-benzyl-4-hydroxy-6-oxo-1H-pyrimidin-5-yl)propanoate Traditional Name: 2-(2-benzyl-4-hydroxy-6-keto-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(N=C(NC1=O)CC2=CC=CC=C2)O

Isomeric SMILES

CCCCCOC(=O)C(C)C1=C(N=C(NC1=O)CC2=CC=CC=C2)O

InChI

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