N-cyclopentyl-5-[4-oxidanyl-1-[(1-pyridin-2-ylpyrrol-2-yl)methyl]piperidin-1-ium-4-yl]-1-benzofuran-2-carboxamide

Systemtic Name: N-cyclopentyl-5-[4-oxidanyl-1-[(1-pyridin-2-ylpyrrol-2-yl)methyl]piperidin-1-ium-4-yl]-1-benzofuran-2-carboxamide Openeye Name: N-cyclopentyl-5-[4-hydroxy-1-[[1-(2-pyridyl)pyrrol-2-yl]methyl]piperidin-1-ium-4-yl]benzofuran-2-carboxamide CAS Name: N-cyclopentyl-5-[4-hydroxy-1-[[1-(2-pyridinyl)-2-pyrrolyl]methyl]-4-piperidin-1-iumyl]-2-benzofurancarboxamide IUPAC Name: N-cyclopentyl-5-[4-hydroxy-1-[(1-pyridin-2-ylpyrrol-2-yl)methyl]piperidin-1-ium-4-yl]-1-benzofuran-2-carboxamide Traditional Name: N-cyclopentyl-5-[4-hydroxy-1-[[1-(2-pyridyl)pyrrol-2-yl]methyl]piperidin-1-ium-4-yl]coumarilamide Formula: C29H33N4O3+ MolecularWeight: 485.59732

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)C2=CC3=C(O2)C=CC(=C3)C4(CC[NH+](CC4)CC5=CC=CN5C6=CC=CC=N6)O

Isomeric SMILES

C1CCC(C1)NC(=O)C2=CC3=C(O2)C=CC(=C3)C4(CC[NH+](CC4)CC5=CC=CN5C6=CC=CC=N6)O

InChI

InChI=1S/C29H32N4O3/c34-28(31-23-6-1-2-7-23)26-19-21-18-22(10-11-25(21)36-26)29(35)12-16-32(17-13-29)20-24-8-5-15-33(24)27-9-3-4-14-30-27/h3-5,8-11,14-15,18-19,23,35H,1-2,6-7,12-13,16-17,20H2,(H,31,34)/p+1