3-(5-chloranyl-2-fluoranyl-phenyl)carbonylpyrazine-2-carboxylic acid

Systemtic Name: 3-(5-chloranyl-2-fluoranyl-phenyl)carbonylpyrazine-2-carboxylic acid Openeye Name: 3-(5-chloro-2-fluoro-benzoyl)pyrazine-2-carboxylic acid CAS Name: 3-[(5-chloro-2-fluorophenyl)-oxomethyl]-2-pyrazinecarboxylic acid IUPAC Name: 3-(5-chloro-2-fluorobenzoyl)pyrazine-2-carboxylic acid Traditional Name: 3-(5-chloro-2-fluoro-benzoyl)pyrazinoic acid Formula: C12H6ClFN2O3 MolecularWeight: 280.639043

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)C(=O)C2=NC=CN=C2C(=O)O)F

Isomeric SMILES

C1=CC(=C(C=C1Cl)C(=O)C2=NC=CN=C2C(=O)O)F

InChI

InChI=1S/C12H6ClFN2O3/c13-6-1-2-8(14)7(5-6)11(17)9-10(12(18)19)16-4-3-15-9/h1-5H,(H,18,19)