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

Systemtic Name: 1-(4-methylquinolin-2-yl)-5-(trifluoromethyl)pyrazole-4-carboxylate Openeye Name: 1-(4-methyl-2-quinolyl)-5-(trifluoromethyl)pyrazole-4-carboxylate CAS Name: 1-(4-methyl-2-quinolinyl)-5-(trifluoromethyl)-4-pyrazolecarboxylate IUPAC Name: 1-(4-methylquinolin-2-yl)-5-(trifluoromethyl)pyrazole-4-carboxylate Traditional Name: 1-(4-methyl-2-quinolyl)-5-(trifluoromethyl)pyrazole-4-carboxylate Formula: C15H9F3N3O2- MolecularWeight: 320.24607

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)N3C(=C(C=N3)C(=O)[O-])C(F)(F)F

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)N3C(=C(C=N3)C(=O)[O-])C(F)(F)F

InChI

InChI=1S/C15H10F3N3O2/c1-8-6-12(20-11-5-3-2-4-9(8)11)21-13(15(16,17)18)10(7-19-21)14(22)23/h2-7H,1H3,(H,22,23)/p-1