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

Systemtic Name: 5-[1-(cyclohexylmethyl)-4-oxidanyl-piperidin-1-ium-4-yl]-N-methyl-N-(2-pyridin-2-ylethyl)-1-benzofuran-2-carboxamide Openeye Name: 5-[1-(cyclohexylmethyl)-4-hydroxy-piperidin-1-ium-4-yl]-N-methyl-N-[2-(2-pyridyl)ethyl]benzofuran-2-carboxamide CAS Name: 5-[1-(cyclohexylmethyl)-4-hydroxy-4-piperidin-1-iumyl]-N-methyl-N-[2-(2-pyridinyl)ethyl]-2-benzofurancarboxamide IUPAC Name: 5-[1-(cyclohexylmethyl)-4-hydroxypiperidin-1-ium-4-yl]-N-methyl-N-(2-pyridin-2-ylethyl)-1-benzofuran-2-carboxamide Traditional Name: 5-[1-(cyclohexylmethyl)-4-hydroxy-piperidin-1-ium-4-yl]-N-methyl-N-[2-(2-pyridyl)ethyl]coumarilamide Formula: C29H38N3O3+ MolecularWeight: 476.63032

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=N1)C(=O)C2=CC3=C(O2)C=CC(=C3)C4(CC[NH+](CC4)CC5CCCCC5)O

Isomeric SMILES

CN(CCC1=CC=CC=N1)C(=O)C2=CC3=C(O2)C=CC(=C3)C4(CC[NH+](CC4)CC5CCCCC5)O

InChI

InChI=1S/C29H37N3O3/c1-31(16-12-25-9-5-6-15-30-25)28(33)27-20-23-19-24(10-11-26(23)35-27)29(34)13-17-32(18-14-29)21-22-7-3-2-4-8-22/h5-6,9-11,15,19-20,22,34H,2-4,7-8,12-14,16-18,21H2,1H3/p+1