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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-5-[1-(furan-2-ylmethyl)-4-oxidanyl-piperidin-1-ium-4-yl]-1-benzofuran-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-5-[1-(2-furylmethyl)-4-hydroxy-piperidin-1-ium-4-yl]benzofuran-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-5-[1-(2-furanylmethyl)-4-hydroxy-4-piperidin-1-iumyl]-2-benzofurancarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-5-[1-(furan-2-ylmethyl)-4-hydroxypiperidin-1-ium-4-yl]-1-benzofuran-2-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-5-[1-(2-furfuryl)-4-hydroxy-piperidin-1-ium-4-yl]coumarilamide Formula: C26H25N2O6+ MolecularWeight: 461.4865

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1(C2=CC3=C(C=C2)OC(=C3)C(=O)NC4=CC5=C(C=C4)OCO5)O)CC6=CC=CO6

Isomeric SMILES

C1C[NH+](CCC1(C2=CC3=C(C=C2)OC(=C3)C(=O)NC4=CC5=C(C=C4)OCO5)O)CC6=CC=CO6

InChI

InChI=1S/C26H24N2O6/c29-25(27-19-4-6-22-23(14-19)33-16-32-22)24-13-17-12-18(3-5-21(17)34-24)26(30)7-9-28(10-8-26)15-20-2-1-11-31-20/h1-6,11-14,30H,7-10,15-16H2,(H,27,29)/p+1