(4-fluorophenyl)methyl 2-pyridin-3-ylquinoline-4-carboxylate

Systemtic Name: (4-fluorophenyl)methyl 2-pyridin-3-ylquinoline-4-carboxylate Openeye Name: (4-fluorophenyl)methyl 2-(3-pyridyl)quinoline-4-carboxylate CAS Name: 2-(3-pyridinyl)-4-quinolinecarboxylic acid (4-fluorophenyl)methyl ester IUPAC Name: (4-fluorophenyl)methyl 2-pyridin-3-ylquinoline-4-carboxylate Traditional Name: 2-(3-pyridyl)cinchoninic acid (4-fluorobenzyl) ester Formula: C22H15FN2O2 MolecularWeight: 358.365103

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CN=CC=C3)C(=O)OCC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CN=CC=C3)C(=O)OCC4=CC=C(C=C4)F

InChI

InChI=1S/C22H15FN2O2/c23-17-9-7-15(8-10-17)14-27-22(26)19-12-21(16-4-3-11-24-13-16)25-20-6-2-1-5-18(19)20/h1-13H,14H2