[2-(4-phenyl-4,5-dihydro-1,3-oxazol-2-yl)quinolin-8-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [2-(4-phenyl-4,5-dihydro-1,3-oxazol-2-yl)quinolin-8-yl] tris(fluoranyl)methanesulfonate Openeye Name: [2-(4-phenyl-4,5-dihydrooxazol-2-yl)-8-quinolyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [2-(4-phenyl-4,5-dihydrooxazol-2-yl)-8-quinolinyl] ester IUPAC Name: [2-(4-phenyl-4,5-dihydro-1,3-oxazol-2-yl)quinolin-8-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [2-(4-phenyl-2-oxazolin-2-yl)-8-quinolyl] ester Formula: C19H13F3N2O4S MolecularWeight: 422.37773

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(N=C(O1)C2=NC3=C(C=CC=C3OS(=O)(=O)C(F)(F)F)C=C2)C4=CC=CC=C4

Isomeric SMILES

C1C(N=C(O1)C2=NC3=C(C=CC=C3OS(=O)(=O)C(F)(F)F)C=C2)C4=CC=CC=C4

InChI

InChI=1S/C19H13F3N2O4S/c20-19(21,22)29(25,26)28-16-8-4-7-13-9-10-14(23-17(13)16)18-24-15(11-27-18)12-5-2-1-3-6-12/h1-10,15H,11H2