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

Systemtic Name: N-(1,3-benzodioxol-5-yl)-5-[1-(cyclohexylmethyl)-4-oxidanyl-piperidin-1-ium-4-yl]-1-benzofuran-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-5-[1-(cyclohexylmethyl)-4-hydroxy-piperidin-1-ium-4-yl]benzofuran-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-5-[1-(cyclohexylmethyl)-4-hydroxy-4-piperidin-1-iumyl]-2-benzofurancarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-5-[1-(cyclohexylmethyl)-4-hydroxypiperidin-1-ium-4-yl]-1-benzofuran-2-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-5-[1-(cyclohexylmethyl)-4-hydroxy-piperidin-1-ium-4-yl]coumarilamide Formula: C28H33N2O5+ MolecularWeight: 477.57202

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C[NH+]2CCC(CC2)(C3=CC4=C(C=C3)OC(=C4)C(=O)NC5=CC6=C(C=C5)OCO6)O

Isomeric SMILES

C1CCC(CC1)C[NH+]2CCC(CC2)(C3=CC4=C(C=C3)OC(=C4)C(=O)NC5=CC6=C(C=C5)OCO6)O

InChI

InChI=1S/C28H32N2O5/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/h6-9,14-16,19,32H,1-5,10-13,17-18H2,(H,29,31)/p+1