(5-chloranylpyridin-3-yl) 4-oxidanylidene-7-(trifluoromethyl)-1H-quinoline-3-carboxylate

Systemtic Name: (5-chloranylpyridin-3-yl) 4-oxidanylidene-7-(trifluoromethyl)-1H-quinoline-3-carboxylate Openeye Name: (5-chloro-3-pyridyl) 4-oxo-7-(trifluoromethyl)-1H-quinoline-3-carboxylate CAS Name: 4-oxo-7-(trifluoromethyl)-1H-quinoline-3-carboxylic acid (5-chloro-3-pyridinyl) ester IUPAC Name: (5-chloropyridin-3-yl) 4-oxo-7-(trifluoromethyl)-1H-quinoline-3-carboxylate Traditional Name: 4-keto-7-(trifluoromethyl)-1H-quinoline-3-carboxylic acid (5-chloro-3-pyridyl) ester Formula: C16H8ClF3N2O3 MolecularWeight: 368.69453

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(F)(F)F)NC=C(C2=O)C(=O)OC3=CC(=CN=C3)Cl

Isomeric SMILES

C1=CC2=C(C=C1C(F)(F)F)NC=C(C2=O)C(=O)OC3=CC(=CN=C3)Cl

InChI

InChI=1S/C16H8ClF3N2O3/c17-9-4-10(6-21-5-9)25-15(24)12-7-22-13-3-8(16(18,19)20)1-2-11(13)14(12)23/h1-7H,(H,22,23)