1-quinolin-2-yl-5-(trifluoromethyl)pyrazole-4-carboxylate

Systemtic Name: 1-quinolin-2-yl-5-(trifluoromethyl)pyrazole-4-carboxylate Openeye Name: 1-(2-quinolyl)-5-(trifluoromethyl)pyrazole-4-carboxylate CAS Name: 1-(2-quinolinyl)-5-(trifluoromethyl)-4-pyrazolecarboxylate IUPAC Name: 1-quinolin-2-yl-5-(trifluoromethyl)pyrazole-4-carboxylate Traditional Name: 1-(2-quinolyl)-5-(trifluoromethyl)pyrazole-4-carboxylate Formula: C14H7F3N3O2- MolecularWeight: 306.21949

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)N3C(=C(C=N3)C(=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)N3C(=C(C=N3)C(=O)[O-])C(F)(F)F

InChI

InChI=1S/C14H8F3N3O2/c15-14(16,17)12-9(13(21)22)7-18-20(12)11-6-5-8-3-1-2-4-10(8)19-11/h1-7H,(H,21,22)/p-1