1-[5-(2-piperidin-1-ium-1-ylethoxy)-1-benzofuran-3-yl]ethanone

Systemtic Name: 1-[5-(2-piperidin-1-ium-1-ylethoxy)-1-benzofuran-3-yl]ethanone Openeye Name: 1-[5-(2-piperidin-1-ium-1-ylethoxy)benzofuran-3-yl]ethanone CAS Name: 1-[5-[2-(1-piperidin-1-iumyl)ethoxy]-3-benzofuranyl]ethanone IUPAC Name: 1-[5-(2-piperidin-1-ium-1-ylethoxy)-1-benzofuran-3-yl]ethanone Traditional Name: 1-[5-(2-piperidin-1-ium-1-ylethoxy)benzofuran-3-yl]ethanone Formula: C17H22NO3+ MolecularWeight: 288.36148

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=COC2=C1C=C(C=C2)OCC[NH+]3CCCCC3

Isomeric SMILES

CC(=O)C1=COC2=C1C=C(C=C2)OCC[NH+]3CCCCC3

InChI

InChI=1S/C17H21NO3/c1-13(19)16-12-21-17-6-5-14(11-15(16)17)20-10-9-18-7-3-2-4-8-18/h5-6,11-12H,2-4,7-10H2,1H3/p+1