5-chloranyl-6,8-dimethoxy-4-(trifluoromethyl)quinoline-3-carboxylate

Systemtic Name: 5-chloranyl-6,8-dimethoxy-4-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: 5-chloro-6,8-dimethoxy-4-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 5-chloro-6,8-dimethoxy-4-(trifluoromethyl)-3-quinolinecarboxylate IUPAC Name: 5-chloro-6,8-dimethoxy-4-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 5-chloro-6,8-dimethoxy-4-(trifluoromethyl)quinoline-3-carboxylate Formula: C13H8ClF3NO4- MolecularWeight: 334.65513

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C2=C(C(=CN=C12)C(=O)[O-])C(F)(F)F)Cl)OC

Isomeric SMILES

COC1=CC(=C(C2=C(C(=CN=C12)C(=O)[O-])C(F)(F)F)Cl)OC

InChI

InChI=1S/C13H9ClF3NO4/c1-21-6-3-7(22-2)11-8(10(6)14)9(13(15,16)17)5(4-18-11)12(19)20/h3-4H,1-2H3,(H,19,20)/p-1