3-[4-(4-fluorophenyl)pyrimidin-2-yl]benzoic acid

Systemtic Name: 3-[4-(4-fluorophenyl)pyrimidin-2-yl]benzoic acid Openeye Name: 3-[4-(4-fluorophenyl)pyrimidin-2-yl]benzoic acid CAS Name: 3-[4-(4-fluorophenyl)-2-pyrimidinyl]benzoic acid IUPAC Name: 3-[4-(4-fluorophenyl)pyrimidin-2-yl]benzoic acid Traditional Name: 3-[4-(4-fluorophenyl)pyrimidin-2-yl]benzoic acid Formula: C17H11FN2O2 MolecularWeight: 294.279843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)O)C2=NC=CC(=N2)C3=CC=C(C=C3)F

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)O)C2=NC=CC(=N2)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H11FN2O2/c18-14-6-4-11(5-7-14)15-8-9-19-16(20-15)12-2-1-3-13(10-12)17(21)22/h1-10H,(H,21,22)