(E)-2-cyano-3-(4-piperidin-1-ylphenyl)-N-[2-(trifluoromethyl)phenyl]prop-2-enamide

Systemtic Name: (E)-2-cyano-3-(4-piperidin-1-ylphenyl)-N-[2-(trifluoromethyl)phenyl]prop-2-enamide Openeye Name: (E)-2-cyano-3-[4-(1-piperidyl)phenyl]-N-[2-(trifluoromethyl)phenyl]prop-2-enamide CAS Name: (E)-2-cyano-3-[4-(1-piperidinyl)phenyl]-N-[2-(trifluoromethyl)phenyl]-2-propenamide IUPAC Name: (E)-2-cyano-3-(4-piperidin-1-ylphenyl)-N-[2-(trifluoromethyl)phenyl]prop-2-enamide Traditional Name: (E)-2-cyano-3-(4-piperidinophenyl)-N-[2-(trifluoromethyl)phenyl]acrylamide Formula: C22H20F3N3O MolecularWeight: 399.40891

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)C=C(C#N)C(=O)NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)/C=C(\C#N)/C(=O)NC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C22H20F3N3O/c23-22(24,25)19-6-2-3-7-20(19)27-21(29)17(15-26)14-16-8-10-18(11-9-16)28-12-4-1-5-13-28/h2-3,6-11,14H,1,4-5,12-13H2,(H,27,29)/b17-14+