N-[(2-morpholin-4-ylpyridin-1-ium-4-yl)methyl]-5-[3-(trifluoromethyl)phenyl]furan-2-carboxamide

Systemtic Name: N-[(2-morpholin-4-ylpyridin-1-ium-4-yl)methyl]-5-[3-(trifluoromethyl)phenyl]furan-2-carboxamide Openeye Name: N-[(2-morpholinopyridin-1-ium-4-yl)methyl]-5-[3-(trifluoromethyl)phenyl]furan-2-carboxamide CAS Name: N-[[2-(4-morpholinyl)-4-pyridin-1-iumyl]methyl]-5-[3-(trifluoromethyl)phenyl]-2-furancarboxamide IUPAC Name: N-[(2-morpholin-4-ylpyridin-1-ium-4-yl)methyl]-5-[3-(trifluoromethyl)phenyl]furan-2-carboxamide Traditional Name: N-[(2-morpholinopyridin-1-ium-4-yl)methyl]-5-[3-(trifluoromethyl)phenyl]-2-furamide Formula: C22H21F3N3O3+ MolecularWeight: 432.41565

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=CC(=C2)CNC(=O)C3=CC=C(O3)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1COCCN1C2=[NH+]C=CC(=C2)CNC(=O)C3=CC=C(O3)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C22H20F3N3O3/c23-22(24,25)17-3-1-2-16(13-17)18-4-5-19(31-18)21(29)27-14-15-6-7-26-20(12-15)28-8-10-30-11-9-28/h1-7,12-13H,8-11,14H2,(H,27,29)/p+1