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

Systemtic Name: N-cyclopropyl-2-[1-[[5-(hydroxymethyl)furan-2-yl]methyl]piperidin-1-ium-4-yl]oxy-4-methoxy-benzamide Openeye Name: N-cyclopropyl-2-[1-[[5-(hydroxymethyl)-2-furyl]methyl]piperidin-1-ium-4-yl]oxy-4-methoxy-benzamide CAS Name: N-cyclopropyl-2-[[1-[[5-(hydroxymethyl)-2-furanyl]methyl]-4-piperidin-1-iumyl]oxy]-4-methoxybenzamide IUPAC Name: N-cyclopropyl-2-[1-[[5-(hydroxymethyl)furan-2-yl]methyl]piperidin-1-ium-4-yl]oxy-4-methoxybenzamide Traditional Name: N-cyclopropyl-4-methoxy-2-[1-[(5-methylol-2-furyl)methyl]piperidin-1-ium-4-yl]oxy-benzamide Formula: C22H29N2O5+ MolecularWeight: 401.47606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)NC2CC2)OC3CC[NH+](CC3)CC4=CC=C(O4)CO

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)NC2CC2)OC3CC[NH+](CC3)CC4=CC=C(O4)CO

InChI

InChI=1S/C22H28N2O5/c1-27-17-6-7-20(22(26)23-15-2-3-15)21(12-17)29-16-8-10-24(11-9-16)13-18-4-5-19(14-25)28-18/h4-7,12,15-16,25H,2-3,8-11,13-14H2,1H3,(H,23,26)/p+1