1-[1-(1-benzofuran-2-ylmethyl)piperidin-1-ium-4-yl]-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[1-(1-benzofuran-2-ylmethyl)piperidin-1-ium-4-yl]-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Openeye Name: 1-[1-(benzofuran-2-ylmethyl)piperidin-1-ium-4-yl]-N-(3-pyridylmethyl)piperidine-4-carboxamide CAS Name: 1-[1-(2-benzofuranylmethyl)-4-piperidin-1-iumyl]-N-(3-pyridinylmethyl)-4-piperidinecarboxamide IUPAC Name: 1-[1-(1-benzofuran-2-ylmethyl)piperidin-1-ium-4-yl]-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide Traditional Name: 1-[1-(benzofuran-2-ylmethyl)piperidin-1-ium-4-yl]-N-(3-pyridylmethyl)isonipecotamide Formula: C26H33N4O2+ MolecularWeight: 433.56582

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2CCC(CC2)C(=O)NCC3=CN=CC=C3)CC4=CC5=CC=CC=C5O4

Isomeric SMILES

C1C[NH+](CCC1N2CCC(CC2)C(=O)NCC3=CN=CC=C3)CC4=CC5=CC=CC=C5O4

InChI

InChI=1S/C26H32N4O2/c31-26(28-18-20-4-3-11-27-17-20)21-7-14-30(15-8-21)23-9-12-29(13-10-23)19-24-16-22-5-1-2-6-25(22)32-24/h1-6,11,16-17,21,23H,7-10,12-15,18-19H2,(H,28,31)/p+1