N-[2-(4-fluorophenyl)carbonyl-5-methoxy-1-benzofuran-3-yl]-2-piperidin-1-ium-1-yl-ethanamide

Systemtic Name: N-[2-(4-fluorophenyl)carbonyl-5-methoxy-1-benzofuran-3-yl]-2-piperidin-1-ium-1-yl-ethanamide Openeye Name: N-[2-(4-fluorobenzoyl)-5-methoxy-benzofuran-3-yl]-2-piperidin-1-ium-1-yl-acetamide CAS Name: N-[2-[(4-fluorophenyl)-oxomethyl]-5-methoxy-3-benzofuranyl]-2-(1-piperidin-1-iumyl)acetamide IUPAC Name: N-[2-(4-fluorobenzoyl)-5-methoxy-1-benzofuran-3-yl]-2-piperidin-1-ium-1-ylacetamide Traditional Name: N-[2-(4-fluorobenzoyl)-5-methoxy-benzofuran-3-yl]-2-piperidin-1-ium-1-yl-acetamide Formula: C23H24FN2O4+ MolecularWeight: 411.446063

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC(=C2NC(=O)C[NH+]3CCCCC3)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

COC1=CC2=C(C=C1)OC(=C2NC(=O)C[NH+]3CCCCC3)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H23FN2O4/c1-29-17-9-10-19-18(13-17)21(25-20(27)14-26-11-3-2-4-12-26)23(30-19)22(28)15-5-7-16(24)8-6-15/h5-10,13H,2-4,11-12,14H2,1H3,(H,25,27)/p+1