diethyl-[[2-[[(5-fluoranyl-3-methyl-1-benzofuran-2-yl)carbonylamino]methyl]phenyl]methyl]azanium

Systemtic Name: diethyl-[[2-[[(5-fluoranyl-3-methyl-1-benzofuran-2-yl)carbonylamino]methyl]phenyl]methyl]azanium Openeye Name: diethyl-[[2-[[(5-fluoro-3-methyl-benzofuran-2-carbonyl)amino]methyl]phenyl]methyl]ammonium CAS Name: diethyl-[[2-[[[(5-fluoro-3-methyl-2-benzofuranyl)-oxomethyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: diethyl-[[2-[[(5-fluoro-3-methyl-1-benzofuran-2-carbonyl)amino]methyl]phenyl]methyl]azanium Traditional Name: diethyl-[2-[[(5-fluoro-3-methyl-benzofuran-2-carbonyl)amino]methyl]benzyl]ammonium Formula: C22H26FN2O2+ MolecularWeight: 369.452443

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=CC=CC=C1CNC(=O)C2=C(C3=C(O2)C=CC(=C3)F)C

Isomeric SMILES

CC[NH+](CC)CC1=CC=CC=C1CNC(=O)C2=C(C3=C(O2)C=CC(=C3)F)C

InChI

InChI=1S/C22H25FN2O2/c1-4-25(5-2)14-17-9-7-6-8-16(17)13-24-22(26)21-15(3)19-12-18(23)10-11-20(19)27-21/h6-12H,4-5,13-14H2,1-3H3,(H,24,26)/p+1