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

Systemtic Name: N-(3,4-dimethoxyphenyl)-5-[1-(furan-3-ylmethyl)-4-oxidanyl-piperidin-1-ium-4-yl]-1-benzofuran-2-carboxamide Openeye Name: N-(3,4-dimethoxyphenyl)-5-[1-(3-furylmethyl)-4-hydroxy-piperidin-1-ium-4-yl]benzofuran-2-carboxamide CAS Name: N-(3,4-dimethoxyphenyl)-5-[1-(3-furanylmethyl)-4-hydroxy-4-piperidin-1-iumyl]-2-benzofurancarboxamide IUPAC Name: N-(3,4-dimethoxyphenyl)-5-[1-(furan-3-ylmethyl)-4-hydroxypiperidin-1-ium-4-yl]-1-benzofuran-2-carboxamide Traditional Name: N-(3,4-dimethoxyphenyl)-5-[1-(3-furfuryl)-4-hydroxy-piperidin-1-ium-4-yl]coumarilamide Formula: C27H29N2O6+ MolecularWeight: 477.52896

Click to see the large picture

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=COC=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=COC=C5)O)OC

InChI

InChI=1S/C27H28N2O6/c1-32-23-6-4-21(15-24(23)33-2)28-26(30)25-14-19-13-20(3-5-22(19)35-25)27(31)8-10-29(11-9-27)16-18-7-12-34-17-18/h3-7,12-15,17,31H,8-11,16H2,1-2H3,(H,28,30)/p+1