1-(1-benzofuran-2-yl)-3-piperidin-1-ium-1-yl-propan-1-one

Systemtic Name: 1-(1-benzofuran-2-yl)-3-piperidin-1-ium-1-yl-propan-1-one Openeye Name: 1-(benzofuran-2-yl)-3-piperidin-1-ium-1-yl-propan-1-one CAS Name: 1-(2-benzofuranyl)-3-(1-piperidin-1-iumyl)-1-propanone IUPAC Name: 1-(1-benzofuran-2-yl)-3-piperidin-1-ium-1-ylpropan-1-one Traditional Name: 1-(benzofuran-2-yl)-3-piperidin-1-ium-1-yl-propan-1-one Formula: C16H20NO2+ MolecularWeight: 258.3355

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCC(=O)C2=CC3=CC=CC=C3O2

Isomeric SMILES

C1CC[NH+](CC1)CCC(=O)C2=CC3=CC=CC=C3O2

InChI

InChI=1S/C16H19NO2/c18-14(8-11-17-9-4-1-5-10-17)16-12-13-6-2-3-7-15(13)19-16/h2-3,6-7,12H,1,4-5,8-11H2/p+1