N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-butoxyphenyl)quinoline-4-carboxamide

Systemtic Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-butoxyphenyl)quinoline-4-carboxamide Openeye Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-butoxyphenyl)quinoline-4-carboxamide CAS Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-butoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-butoxyphenyl)quinoline-4-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)phenyl]-2-(4-butoxyphenyl)cinchoninamide Formula: C28H22F6N2O2 MolecularWeight: 532.476899

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C28H22F6N2O2/c1-2-3-12-38-21-10-8-17(9-11-21)25-16-23(22-6-4-5-7-24(22)36-25)26(37)35-20-14-18(27(29,30)31)13-19(15-20)28(32,33)34/h4-11,13-16H,2-3,12H2,1H3,(H,35,37)