5-[4-oxidanyl-1-[(2-prop-2-enoxyphenyl)methyl]piperidin-1-ium-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]-1-benzofuran-2-carboxamide

Systemtic Name: 5-[4-oxidanyl-1-[(2-prop-2-enoxyphenyl)methyl]piperidin-1-ium-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]-1-benzofuran-2-carboxamide Openeye Name: 5-[1-[(2-allyloxyphenyl)methyl]-4-hydroxy-piperidin-1-ium-4-yl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]benzofuran-2-carboxamide CAS Name: 5-[4-hydroxy-1-[(2-prop-2-enoxyphenyl)methyl]-4-piperidin-1-iumyl]-N-[[(2R)-2-oxolanyl]methyl]-2-benzofurancarboxamide IUPAC Name: 5-[4-hydroxy-1-[(2-prop-2-enoxyphenyl)methyl]piperidin-1-ium-4-yl]-N-[[(2R)-oxolan-2-yl]methyl]-1-benzofuran-2-carboxamide Traditional Name: 5-[1-(2-allyloxybenzyl)-4-hydroxy-piperidin-1-ium-4-yl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]coumarilamide Formula: C29H35N2O5+ MolecularWeight: 491.5986

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=CC=C1C[NH+]2CCC(CC2)(C3=CC4=C(C=C3)OC(=C4)C(=O)NCC5CCCO5)O

Isomeric SMILES

C=CCOC1=CC=CC=C1C[NH+]2CCC(CC2)(C3=CC4=C(C=C3)OC(=C4)C(=O)NC[C@H]5CCCO5)O

InChI

InChI=1S/C29H34N2O5/c1-2-15-35-25-8-4-3-6-21(25)20-31-13-11-29(33,12-14-31)23-9-10-26-22(17-23)18-27(36-26)28(32)30-19-24-7-5-16-34-24/h2-4,6,8-10,17-18,24,33H,1,5,7,11-16,19-20H2,(H,30,32)/p+1/t24-/m1/s1