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

Systemtic Name: 2-[2-(hydroxymethyl)-4-oxidanylidene-6-phenyl-1H-pyrimidin-5-yl]propanoic acid Openeye Name: 2-[2-(hydroxymethyl)-4-oxo-6-phenyl-1H-pyrimidin-5-yl]propanoic acid CAS Name: 2-[2-(hydroxymethyl)-4-oxo-6-phenyl-1H-pyrimidin-5-yl]propanoic acid IUPAC Name: 2-[2-(hydroxymethyl)-4-oxo-6-phenyl-1H-pyrimidin-5-yl]propanoic acid Traditional Name: 2-(4-keto-2-methylol-6-phenyl-1H-pyrimidin-5-yl)propionic acid Formula: C14H14N2O4 MolecularWeight: 274.27196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N2O4/c1-8(14(19)20)11-12(9-5-3-2-4-6-9)15-10(7-17)16-13(11)18/h2-6,8,17H,7H2,1H3,(H,19,20)(H,15,16,18)