4-[(5-chloranyl-2-fluoranyl-phenyl)methyl]pyridine-3-carboxylic acid

Systemtic Name: 4-[(5-chloranyl-2-fluoranyl-phenyl)methyl]pyridine-3-carboxylic acid Openeye Name: 4-[(5-chloro-2-fluoro-phenyl)methyl]pyridine-3-carboxylic acid CAS Name: 4-[(5-chloro-2-fluorophenyl)methyl]-3-pyridinecarboxylic acid IUPAC Name: 4-[(5-chloro-2-fluorophenyl)methyl]pyridine-3-carboxylic acid Traditional Name: 4-(5-chloro-2-fluoro-benzyl)nicotinic acid Formula: C13H9ClFNO2 MolecularWeight: 265.667463

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)CC2=C(C=NC=C2)C(=O)O)F

Isomeric SMILES

C1=CC(=C(C=C1Cl)CC2=C(C=NC=C2)C(=O)O)F

InChI

InChI=1S/C13H9ClFNO2/c14-10-1-2-12(15)9(6-10)5-8-3-4-16-7-11(8)13(17)18/h1-4,6-7H,5H2,(H,17,18)