5-[4-oxidanyl-1-(phenylmethyl)piperidin-1-ium-4-yl]-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide

Systemtic Name: 5-[4-oxidanyl-1-(phenylmethyl)piperidin-1-ium-4-yl]-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide Openeye Name: 5-(1-benzyl-4-hydroxy-piperidin-1-ium-4-yl)-N-(2-thienylmethyl)benzofuran-2-carboxamide CAS Name: 5-[4-hydroxy-1-(phenylmethyl)-4-piperidin-1-iumyl]-N-(thiophen-2-ylmethyl)-2-benzofurancarboxamide IUPAC Name: 5-(1-benzyl-4-hydroxypiperidin-1-ium-4-yl)-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide Traditional Name: 5-(1-benzyl-4-hydroxy-piperidin-1-ium-4-yl)-N-(2-thenyl)coumarilamide Formula: C26H27N2O3S+ MolecularWeight: 447.56918

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1(C2=CC3=C(C=C2)OC(=C3)C(=O)NCC4=CC=CS4)O)CC5=CC=CC=C5

Isomeric SMILES

C1C[NH+](CCC1(C2=CC3=C(C=C2)OC(=C3)C(=O)NCC4=CC=CS4)O)CC5=CC=CC=C5

InChI

InChI=1S/C26H26N2O3S/c29-25(27-17-22-7-4-14-32-22)24-16-20-15-21(8-9-23(20)31-24)26(30)10-12-28(13-11-26)18-19-5-2-1-3-6-19/h1-9,14-16,30H,10-13,17-18H2,(H,27,29)/p+1