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

Systemtic Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-2-(4-ethoxyphenyl)quinoline-4-carboxamide Openeye Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-2-(4-ethoxyphenyl)quinoline-4-carboxamide CAS Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-2-(4-ethoxyphenyl)-4-quinolinecarboxamide IUPAC Name: N-[[3,5-bis(trifluoromethyl)phenyl]methyl]-2-(4-ethoxyphenyl)quinoline-4-carboxamide Traditional Name: N-[3,5-bis(trifluoromethyl)benzyl]-2-p-phenetyl-cinchoninamide Formula: C27H20F6N2O2 MolecularWeight: 518.450319

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C27H20F6N2O2/c1-2-37-20-9-7-17(8-10-20)24-14-22(21-5-3-4-6-23(21)35-24)25(36)34-15-16-11-18(26(28,29)30)13-19(12-16)27(31,32)33/h3-14H,2,15H2,1H3,(H,34,36)