diethyl-[[2-[(3-fluorophenyl)methylidene]-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl]azanium

Systemtic Name: diethyl-[[2-[(3-fluorophenyl)methylidene]-6-oxidanyl-3-oxidanylidene-1-benzofuran-7-yl]methyl]azanium Openeye Name: diethyl-[[2-[(3-fluorophenyl)methylene]-6-hydroxy-3-oxo-benzofuran-7-yl]methyl]ammonium CAS Name: diethyl-[[2-[(3-fluorophenyl)methylidene]-6-hydroxy-3-oxo-7-benzofuranyl]methyl]ammonium IUPAC Name: diethyl-[[2-[(3-fluorophenyl)methylidene]-6-hydroxy-3-oxo-1-benzofuran-7-yl]methyl]azanium Traditional Name: diethyl-[[2-(3-fluorobenzylidene)-6-hydroxy-3-keto-coumaran-7-yl]methyl]ammonium Formula: C20H21FNO3+ MolecularWeight: 342.384043

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=C(C=CC2=C1OC(=CC3=CC(=CC=C3)F)C2=O)O

Isomeric SMILES

CC[NH+](CC)CC1=C(C=CC2=C1OC(=CC3=CC(=CC=C3)F)C2=O)O

InChI

InChI=1S/C20H20FNO3/c1-3-22(4-2)12-16-17(23)9-8-15-19(24)18(25-20(15)16)11-13-6-5-7-14(21)10-13/h5-11,23H,3-4,12H2,1-2H3/p+1