3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)-N-[2-(trifluoromethyl)phenyl]quinoline-4-carboxamide

Systemtic Name: 3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)-N-[2-(trifluoromethyl)phenyl]quinoline-4-carboxamide Openeye Name: 2-(4-benzyloxyphenyl)-3,6,8-trimethyl-N-[2-(trifluoromethyl)phenyl]quinoline-4-carboxamide CAS Name: 3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)-N-[2-(trifluoromethyl)phenyl]-4-quinolinecarboxamide IUPAC Name: 3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)-N-[2-(trifluoromethyl)phenyl]quinoline-4-carboxamide Traditional Name: 2-(4-benzoxyphenyl)-3,6,8-trimethyl-N-[2-(trifluoromethyl)phenyl]cinchoninamide Formula: C33H27F3N2O2 MolecularWeight: 540.57489

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C)C(=O)NC5=CC=CC=C5C(F)(F)F)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C(C(=N2)C3=CC=C(C=C3)OCC4=CC=CC=C4)C)C(=O)NC5=CC=CC=C5C(F)(F)F)C

InChI

InChI=1S/C33H27F3N2O2/c1-20-17-21(2)30-26(18-20)29(32(39)37-28-12-8-7-11-27(28)33(34,35)36)22(3)31(38-30)24-13-15-25(16-14-24)40-19-23-9-5-4-6-10-23/h4-18H,19H2,1-3H3,(H,37,39)