6,8-dimethyl-4-(trifluoromethyl)quinoline-3-carboxylate

Systemtic Name: 6,8-dimethyl-4-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: 6,8-dimethyl-4-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 6,8-dimethyl-4-(trifluoromethyl)-3-quinolinecarboxylate IUPAC Name: 6,8-dimethyl-4-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 6,8-dimethyl-4-(trifluoromethyl)quinoline-3-carboxylate Formula: C13H9F3NO2- MolecularWeight: 268.21127

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C(C=N2)C(=O)[O-])C(F)(F)F)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C(C=N2)C(=O)[O-])C(F)(F)F)C

InChI

InChI=1S/C13H10F3NO2/c1-6-3-7(2)11-8(4-6)10(13(14,15)16)9(5-17-11)12(18)19/h3-5H,1-2H3,(H,18,19)/p-1