3-oxidanylidene-3-(3-pyrimidin-4-ylphenyl)propanoic acid

Systemtic Name: 3-oxidanylidene-3-(3-pyrimidin-4-ylphenyl)propanoic acid Openeye Name: 3-oxo-3-(3-pyrimidin-4-ylphenyl)propanoic acid CAS Name: 3-oxo-3-[3-(4-pyrimidinyl)phenyl]propanoic acid IUPAC Name: 3-oxo-3-(3-pyrimidin-4-ylphenyl)propanoic acid Traditional Name: 3-keto-3-[3-(4-pyrimidyl)phenyl]propionic acid Formula: C13H10N2O3 MolecularWeight: 242.2301

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10N2O3/c16-12(7-13(17)18)10-3-1-2-9(6-10)11-4-5-14-8-15-11/h1-6,8H,7H2,(H,17,18)