N-[[3-fluoranyl-5-(trifluoromethyl)phenyl]methyl]-2-isoquinolin-5-yl-propanamide

Systemtic Name: N-[[3-fluoranyl-5-(trifluoromethyl)phenyl]methyl]-2-isoquinolin-5-yl-propanamide Openeye Name: N-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]-2-(5-isoquinolyl)propanamide CAS Name: N-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]-2-(5-isoquinolinyl)propanamide IUPAC Name: N-[[3-fluoro-5-(trifluoromethyl)phenyl]methyl]-2-isoquinolin-5-ylpropanamide Traditional Name: N-[3-fluoro-5-(trifluoromethyl)benzyl]-2-(5-isoquinolyl)propionamide Formula: C20H16F4N2O MolecularWeight: 376.347453

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=C1C=CN=C2)C(=O)NCC3=CC(=CC(=C3)F)C(F)(F)F

Isomeric SMILES

CC(C1=CC=CC2=C1C=CN=C2)C(=O)NCC3=CC(=CC(=C3)F)C(F)(F)F

InChI

InChI=1S/C20H16F4N2O/c1-12(17-4-2-3-14-11-25-6-5-18(14)17)19(27)26-10-13-7-15(20(22,23)24)9-16(21)8-13/h2-9,11-12H,10H2,1H3,(H,26,27)