(E)-3-[3-fluoranyl-4-(trifluoromethyl)phenyl]-N-isoquinolin-5-yl-prop-2-enamide

Systemtic Name: (E)-3-[3-fluoranyl-4-(trifluoromethyl)phenyl]-N-isoquinolin-5-yl-prop-2-enamide Openeye Name: (E)-3-[3-fluoro-4-(trifluoromethyl)phenyl]-N-(5-isoquinolyl)prop-2-enamide CAS Name: (E)-3-[3-fluoro-4-(trifluoromethyl)phenyl]-N-(5-isoquinolinyl)-2-propenamide IUPAC Name: (E)-3-[3-fluoro-4-(trifluoromethyl)phenyl]-N-isoquinolin-5-ylprop-2-enamide Traditional Name: (E)-3-[3-fluoro-4-(trifluoromethyl)phenyl]-N-(5-isoquinolyl)acrylamide Formula: C19H12F4N2O MolecularWeight: 360.304993

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)NC(=O)C=CC3=CC(=C(C=C3)C(F)(F)F)F

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)NC(=O)/C=C/C3=CC(=C(C=C3)C(F)(F)F)F

InChI

InChI=1S/C19H12F4N2O/c20-16-10-12(4-6-15(16)19(21,22)23)5-7-18(26)25-17-3-1-2-13-11-24-9-8-14(13)17/h1-11H,(H,25,26)/b7-5+