8-(trifluoromethyl)-4-[[3-(trifluoromethyl)phenyl]amino]quinoline-3-carboxylate

Systemtic Name: 8-(trifluoromethyl)-4-[[3-(trifluoromethyl)phenyl]amino]quinoline-3-carboxylate Openeye Name: 8-(trifluoromethyl)-4-[3-(trifluoromethyl)anilino]quinoline-3-carboxylate CAS Name: 8-(trifluoromethyl)-4-[3-(trifluoromethyl)anilino]-3-quinolinecarboxylate IUPAC Name: 8-(trifluoromethyl)-4-[3-(trifluoromethyl)anilino]quinoline-3-carboxylate Traditional Name: 8-(trifluoromethyl)-4-[3-(trifluoromethyl)anilino]quinoline-3-carboxylate Formula: C18H9F6N2O2- MolecularWeight: 399.266679

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=C3C=CC=C(C3=NC=C2C(=O)[O-])C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC2=C3C=CC=C(C3=NC=C2C(=O)[O-])C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C18H10F6N2O2/c19-17(20,21)9-3-1-4-10(7-9)26-14-11-5-2-6-13(18(22,23)24)15(11)25-8-12(14)16(27)28/h1-8H,(H,25,26)(H,27,28)/p-1