2-(3,4-dimethoxyphenyl)-N-[2-fluoranyl-5-(trifluoromethyl)phenyl]quinoline-4-carboxamide

Systemtic Name: 2-(3,4-dimethoxyphenyl)-N-[2-fluoranyl-5-(trifluoromethyl)phenyl]quinoline-4-carboxamide Openeye Name: 2-(3,4-dimethoxyphenyl)-N-[2-fluoro-5-(trifluoromethyl)phenyl]quinoline-4-carboxamide CAS Name: 2-(3,4-dimethoxyphenyl)-N-[2-fluoro-5-(trifluoromethyl)phenyl]-4-quinolinecarboxamide IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-[2-fluoro-5-(trifluoromethyl)phenyl]quinoline-4-carboxamide Traditional Name: 2-(3,4-dimethoxyphenyl)-N-[2-fluoro-5-(trifluoromethyl)phenyl]cinchoninamide Formula: C25H18F4N2O3 MolecularWeight: 470.415633

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C=CC(=C4)C(F)(F)F)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C=CC(=C4)C(F)(F)F)F)OC

InChI

InChI=1S/C25H18F4N2O3/c1-33-22-10-7-14(11-23(22)34-2)20-13-17(16-5-3-4-6-19(16)30-20)24(32)31-21-12-15(25(27,28)29)8-9-18(21)26/h3-13H,1-2H3,(H,31,32)