4-[1-[[5-(hydroxymethyl)furan-2-yl]methyl]piperidin-1-ium-4-yl]oxy-N-(pyridin-4-ylmethyl)benzamide

Systemtic Name: 4-[1-[[5-(hydroxymethyl)furan-2-yl]methyl]piperidin-1-ium-4-yl]oxy-N-(pyridin-4-ylmethyl)benzamide Openeye Name: 4-[1-[[5-(hydroxymethyl)-2-furyl]methyl]piperidin-1-ium-4-yl]oxy-N-(4-pyridylmethyl)benzamide CAS Name: 4-[[1-[[5-(hydroxymethyl)-2-furanyl]methyl]-4-piperidin-1-iumyl]oxy]-N-(pyridin-4-ylmethyl)benzamide IUPAC Name: 4-[1-[[5-(hydroxymethyl)furan-2-yl]methyl]piperidin-1-ium-4-yl]oxy-N-(pyridin-4-ylmethyl)benzamide Traditional Name: 4-[1-[(5-methylol-2-furyl)methyl]piperidin-1-ium-4-yl]oxy-N-(4-pyridylmethyl)benzamide Formula: C24H28N3O4+ MolecularWeight: 422.49682

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1OC2=CC=C(C=C2)C(=O)NCC3=CC=NC=C3)CC4=CC=C(O4)CO

Isomeric SMILES

C1C[NH+](CCC1OC2=CC=C(C=C2)C(=O)NCC3=CC=NC=C3)CC4=CC=C(O4)CO

InChI

InChI=1S/C24H27N3O4/c28-17-23-6-5-22(31-23)16-27-13-9-21(10-14-27)30-20-3-1-19(2-4-20)24(29)26-15-18-7-11-25-12-8-18/h1-8,11-12,21,28H,9-10,13-17H2,(H,26,29)/p+1