4-(cyanomethoxy)-6-fluoranyl-quinoline-2-carboxylic acid

Systemtic Name: 4-(cyanomethoxy)-6-fluoranyl-quinoline-2-carboxylic acid Openeye Name: 4-(cyanomethoxy)-6-fluoro-quinoline-2-carboxylic acid CAS Name: 4-(cyanomethoxy)-6-fluoro-2-quinolinecarboxylic acid IUPAC Name: 4-(cyanomethoxy)-6-fluoroquinoline-2-carboxylic acid Traditional Name: 4-(cyanomethoxy)-6-fluoro-quinaldic acid Formula: C12H7FN2O3 MolecularWeight: 246.193983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1F)C(=CC(=N2)C(=O)O)OCC#N

Isomeric SMILES

C1=CC2=C(C=C1F)C(=CC(=N2)C(=O)O)OCC#N

InChI

InChI=1S/C12H7FN2O3/c13-7-1-2-9-8(5-7)11(18-4-3-14)6-10(15-9)12(16)17/h1-2,5-6H,4H2,(H,16,17)