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

Systemtic Name: 2-(3,4-dimethoxyphenyl)-N-[[3-(trifluoromethyl)phenyl]methyl]quinoline-4-carboxamide Openeye Name: 2-(3,4-dimethoxyphenyl)-N-[[3-(trifluoromethyl)phenyl]methyl]quinoline-4-carboxamide CAS Name: 2-(3,4-dimethoxyphenyl)-N-[[3-(trifluoromethyl)phenyl]methyl]-4-quinolinecarboxamide IUPAC Name: 2-(3,4-dimethoxyphenyl)-N-[[3-(trifluoromethyl)phenyl]methyl]quinoline-4-carboxamide Traditional Name: 2-(3,4-dimethoxyphenyl)-N-[3-(trifluoromethyl)benzyl]cinchoninamide Formula: C26H21F3N2O3 MolecularWeight: 466.45175

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC(=CC=C4)C(F)(F)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC(=CC=C4)C(F)(F)F)OC

InChI

InChI=1S/C26H21F3N2O3/c1-33-23-11-10-17(13-24(23)34-2)22-14-20(19-8-3-4-9-21(19)31-22)25(32)30-15-16-6-5-7-18(12-16)26(27,28)29/h3-14H,15H2,1-2H3,(H,30,32)