(E)-N-[2-(azetidin-2-yl)quinolin-6-yl]-3-[4-(trifluoromethyl)phenyl]prop-2-enamide

Systemtic Name: (E)-N-[2-(azetidin-2-yl)quinolin-6-yl]-3-[4-(trifluoromethyl)phenyl]prop-2-enamide Openeye Name: (E)-N-[2-(azetidin-2-yl)-6-quinolyl]-3-[4-(trifluoromethyl)phenyl]prop-2-enamide CAS Name: (E)-N-[2-(2-azetidinyl)-6-quinolinyl]-3-[4-(trifluoromethyl)phenyl]-2-propenamide IUPAC Name: (E)-N-[2-(azetidin-2-yl)quinolin-6-yl]-3-[4-(trifluoromethyl)phenyl]prop-2-enamide Traditional Name: (E)-N-[2-(azetidin-2-yl)-6-quinolyl]-3-[4-(trifluoromethyl)phenyl]acrylamide Formula: C22H18F3N3O MolecularWeight: 397.39303

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC1C2=NC3=C(C=C2)C=C(C=C3)NC(=O)C=CC4=CC=C(C=C4)C(F)(F)F

Isomeric SMILES

C1CNC1C2=NC3=C(C=C2)C=C(C=C3)NC(=O)/C=C/C4=CC=C(C=C4)C(F)(F)F

InChI

InChI=1S/C22H18F3N3O/c23-22(24,25)16-5-1-14(2-6-16)3-10-21(29)27-17-7-9-18-15(13-17)4-8-20(28-18)19-11-12-26-19/h1-10,13,19,26H,11-12H2,(H,27,29)/b10-3+