N-(3,4-dimethoxyphenyl)-5-[4-oxidanyl-1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]-1-benzofuran-2-carboxamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-5-[4-oxidanyl-1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]-1-benzofuran-2-carboxamide Openeye Name: N-(3,4-dimethoxyphenyl)-5-[4-hydroxy-1-(3-pyridylmethyl)piperidin-1-ium-4-yl]benzofuran-2-carboxamide CAS Name: N-(3,4-dimethoxyphenyl)-5-[4-hydroxy-1-(3-pyridinylmethyl)-4-piperidin-1-iumyl]-2-benzofurancarboxamide IUPAC Name: N-(3,4-dimethoxyphenyl)-5-[4-hydroxy-1-(pyridin-3-ylmethyl)piperidin-1-ium-4-yl]-1-benzofuran-2-carboxamide Traditional Name: N-(3,4-dimethoxyphenyl)-5-[4-hydroxy-1-(3-pyridylmethyl)piperidin-1-ium-4-yl]coumarilamide Formula: C28H30N3O5+ MolecularWeight: 488.5549

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=CC3=C(O2)C=CC(=C3)C4(CC[NH+](CC4)CC5=CN=CC=C5)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=CC3=C(O2)C=CC(=C3)C4(CC[NH+](CC4)CC5=CN=CC=C5)O)OC

InChI

InChI=1S/C28H29N3O5/c1-34-24-8-6-22(16-25(24)35-2)30-27(32)26-15-20-14-21(5-7-23(20)36-26)28(33)9-12-31(13-10-28)18-19-4-3-11-29-17-19/h3-8,11,14-17,33H,9-10,12-13,18H2,1-2H3,(H,30,32)/p+1