(2-ethoxycarbonyl-1-benzofuran-3-yl)methyl-[(2-fluorophenyl)methyl]-methyl-azanium

Systemtic Name: (2-ethoxycarbonyl-1-benzofuran-3-yl)methyl-[(2-fluorophenyl)methyl]-methyl-azanium Openeye Name: (2-ethoxycarbonylbenzofuran-3-yl)methyl-[(2-fluorophenyl)methyl]-methyl-ammonium CAS Name: (2-ethoxycarbonyl-3-benzofuranyl)methyl-[(2-fluorophenyl)methyl]-methylammonium IUPAC Name: (2-ethoxycarbonyl-1-benzofuran-3-yl)methyl-[(2-fluorophenyl)methyl]-methylazanium Traditional Name: (2-carbethoxybenzofuran-3-yl)methyl-(2-fluorobenzyl)-methyl-ammonium Formula: C20H21FNO3+ MolecularWeight: 342.384043

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)C[NH+](C)CC3=CC=CC=C3F

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)C[NH+](C)CC3=CC=CC=C3F

InChI

InChI=1S/C20H20FNO3/c1-3-24-20(23)19-16(15-9-5-7-11-18(15)25-19)13-22(2)12-14-8-4-6-10-17(14)21/h4-11H,3,12-13H2,1-2H3/p+1