N-[2-(2,3-dihydro-1-benzofuran-5-ylmethylamino)pyridin-3-yl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[2-(2,3-dihydro-1-benzofuran-5-ylmethylamino)pyridin-3-yl]-3-(trifluoromethyl)benzamide Openeye Name: N-[2-(2,3-dihydrobenzofuran-5-ylmethylamino)-3-pyridyl]-3-(trifluoromethyl)benzamide CAS Name: N-[2-(2,3-dihydrobenzofuran-5-ylmethylamino)-3-pyridinyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[2-(2,3-dihydro-1-benzofuran-5-ylmethylamino)pyridin-3-yl]-3-(trifluoromethyl)benzamide Traditional Name: N-[2-(coumaran-5-ylmethylamino)-3-pyridyl]-3-(trifluoromethyl)benzamide Formula: C22H18F3N3O2 MolecularWeight: 413.39243

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)CNC3=C(C=CC=N3)NC(=O)C4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1COC2=C1C=C(C=C2)CNC3=C(C=CC=N3)NC(=O)C4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C22H18F3N3O2/c23-22(24,25)17-4-1-3-16(12-17)21(29)28-18-5-2-9-26-20(18)27-13-14-6-7-19-15(11-14)8-10-30-19/h1-7,9,11-12H,8,10,13H2,(H,26,27)(H,28,29)