5-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-oxidanyl-piperidin-1-ium-4-yl]-N-(2,5-dimethoxyphenyl)-1-benzofuran-2-carboxamide

Systemtic Name: 5-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-oxidanyl-piperidin-1-ium-4-yl]-N-(2,5-dimethoxyphenyl)-1-benzofuran-2-carboxamide Openeye Name: 5-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-hydroxy-piperidin-1-ium-4-yl]-N-(2,5-dimethoxyphenyl)benzofuran-2-carboxamide CAS Name: 5-[1-[[(1S)-1-cyclohex-3-enyl]methyl]-4-hydroxy-4-piperidin-1-iumyl]-N-(2,5-dimethoxyphenyl)-2-benzofurancarboxamide IUPAC Name: 5-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-hydroxypiperidin-1-ium-4-yl]-N-(2,5-dimethoxyphenyl)-1-benzofuran-2-carboxamide Traditional Name: 5-[1-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-hydroxy-piperidin-1-ium-4-yl]-N-(2,5-dimethoxyphenyl)coumarilamide Formula: C29H35N2O5+ MolecularWeight: 491.5986

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=O)C2=CC3=C(O2)C=CC(=C3)C4(CC[NH+](CC4)CC5CCC=CC5)O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=O)C2=CC3=C(O2)C=CC(=C3)C4(CC[NH+](CC4)C[C@H]5CCC=CC5)O

InChI

InChI=1S/C29H34N2O5/c1-34-23-9-11-26(35-2)24(18-23)30-28(32)27-17-21-16-22(8-10-25(21)36-27)29(33)12-14-31(15-13-29)19-20-6-4-3-5-7-20/h3-4,8-11,16-18,20,33H,5-7,12-15,19H2,1-2H3,(H,30,32)/p+1/t20-/m1/s1