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

Systemtic Name: 3-[2-(hydroxymethyl)-4-oxidanylidene-6-phenyl-1H-pyrimidin-5-yl]propanoic acid Openeye Name: 3-[2-(hydroxymethyl)-4-oxo-6-phenyl-1H-pyrimidin-5-yl]propanoic acid CAS Name: 3-[2-(hydroxymethyl)-4-oxo-6-phenyl-1H-pyrimidin-5-yl]propanoic acid IUPAC Name: 3-[2-(hydroxymethyl)-4-oxo-6-phenyl-1H-pyrimidin-5-yl]propanoic acid Traditional Name: 3-(4-keto-2-methylol-6-phenyl-1H-pyrimidin-5-yl)propionic acid Formula: C14H14N2O4 MolecularWeight: 274.27196

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)N=C(N2)CO)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)N=C(N2)CO)CCC(=O)O

InChI

InChI=1S/C14H14N2O4/c17-8-11-15-13(9-4-2-1-3-5-9)10(14(20)16-11)6-7-12(18)19/h1-5,17H,6-8H2,(H,18,19)(H,15,16,20)