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

Systemtic Name: 3-methylbutyl 3-[2-(hydroxymethyl)-4-oxidanylidene-6-phenyl-1H-pyrimidin-5-yl]propanoate Openeye Name: isopentyl 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 3-methylbutyl ester IUPAC Name: 3-methylbutyl 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 isoamyl ester Formula: C19H24N2O4 MolecularWeight: 344.40486

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N2O4/c1-13(2)10-11-25-17(23)9-8-15-18(14-6-4-3-5-7-14)20-16(12-22)21-19(15)24/h3-7,13,22H,8-12H2,1-2H3,(H,20,21,24)