(E)-2-fluoranyl-3-(4-pyrimidin-2-ylphenyl)prop-2-enoic acid

Systemtic Name: (E)-2-fluoranyl-3-(4-pyrimidin-2-ylphenyl)prop-2-enoic acid Openeye Name: (E)-2-fluoro-3-(4-pyrimidin-2-ylphenyl)prop-2-enoic acid CAS Name: (E)-2-fluoro-3-[4-(2-pyrimidinyl)phenyl]-2-propenoic acid IUPAC Name: (E)-2-fluoro-3-(4-pyrimidin-2-ylphenyl)prop-2-enoic acid Traditional Name: (E)-2-fluoro-3-[4-(2-pyrimidyl)phenyl]acrylic acid Formula: C13H9FN2O2 MolecularWeight: 244.221163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)C2=CC=C(C=C2)C=C(C(=O)O)F

Isomeric SMILES

C1=CN=C(N=C1)C2=CC=C(C=C2)/C=C(\C(=O)O)/F

InChI

InChI=1S/C13H9FN2O2/c14-11(13(17)18)8-9-2-4-10(5-3-9)12-15-6-1-7-16-12/h1-8H,(H,17,18)/b11-8+