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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-5-[4-oxidanyl-1-(phenylmethyl)piperidin-1-ium-4-yl]-1-benzofuran-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-5-(1-benzyl-4-hydroxy-piperidin-1-ium-4-yl)benzofuran-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-5-[4-hydroxy-1-(phenylmethyl)-4-piperidin-1-iumyl]-2-benzofurancarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-5-(1-benzyl-4-hydroxypiperidin-1-ium-4-yl)-1-benzofuran-2-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-5-(1-benzyl-4-hydroxy-piperidin-1-ium-4-yl)coumarilamide Formula: C28H27N2O5+ MolecularWeight: 471.52438

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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=CC=C6

Isomeric SMILES

C1C[NH+](CCC1(C2=CC3=C(C=C2)OC(=C3)C(=O)NC4=CC5=C(C=C4)OCO5)O)CC6=CC=CC=C6

InChI

InChI=1S/C28H26N2O5/c31-27(29-22-7-9-24-25(16-22)34-18-33-24)26-15-20-14-21(6-8-23(20)35-26)28(32)10-12-30(13-11-28)17-19-4-2-1-3-5-19/h1-9,14-16,32H,10-13,17-18H2,(H,29,31)/p+1