5-[(4-fluorophenyl)methyl]pyrimidine-2-carboxylic acid

Systemtic Name: 5-[(4-fluorophenyl)methyl]pyrimidine-2-carboxylic acid Openeye Name: 5-[(4-fluorophenyl)methyl]pyrimidine-2-carboxylic acid CAS Name: 5-[(4-fluorophenyl)methyl]-2-pyrimidinecarboxylic acid IUPAC Name: 5-[(4-fluorophenyl)methyl]pyrimidine-2-carboxylic acid Traditional Name: 5-(4-fluorobenzyl)pyrimidine-2-carboxylic acid Formula: C12H9FN2O2 MolecularWeight: 232.210463

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=CN=C(N=C2)C(=O)O)F

Isomeric SMILES

C1=CC(=CC=C1CC2=CN=C(N=C2)C(=O)O)F

InChI

InChI=1S/C12H9FN2O2/c13-10-3-1-8(2-4-10)5-9-6-14-11(12(16)17)15-7-9/h1-4,6-7H,5H2,(H,16,17)