4-[1-[(5-methoxy-2-oxidanyl-phenyl)methyl]piperidin-1-ium-4-yl]oxy-N-(pyridin-2-ylmethyl)benzamide

Systemtic Name: 4-[1-[(5-methoxy-2-oxidanyl-phenyl)methyl]piperidin-1-ium-4-yl]oxy-N-(pyridin-2-ylmethyl)benzamide Openeye Name: 4-[1-[(2-hydroxy-5-methoxy-phenyl)methyl]piperidin-1-ium-4-yl]oxy-N-(2-pyridylmethyl)benzamide CAS Name: 4-[[1-[(2-hydroxy-5-methoxyphenyl)methyl]-4-piperidin-1-iumyl]oxy]-N-(2-pyridinylmethyl)benzamide IUPAC Name: 4-[1-[(2-hydroxy-5-methoxyphenyl)methyl]piperidin-1-ium-4-yl]oxy-N-(pyridin-2-ylmethyl)benzamide Traditional Name: 4-[1-(2-hydroxy-5-methoxy-benzyl)piperidin-1-ium-4-yl]oxy-N-(2-pyridylmethyl)benzamide Formula: C26H30N3O4+ MolecularWeight: 448.5341

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)O)C[NH+]2CCC(CC2)OC3=CC=C(C=C3)C(=O)NCC4=CC=CC=N4

Isomeric SMILES

COC1=CC(=C(C=C1)O)C[NH+]2CCC(CC2)OC3=CC=C(C=C3)C(=O)NCC4=CC=CC=N4

InChI

InChI=1S/C26H29N3O4/c1-32-24-9-10-25(30)20(16-24)18-29-14-11-23(12-15-29)33-22-7-5-19(6-8-22)26(31)28-17-21-4-2-3-13-27-21/h2-10,13,16,23,30H,11-12,14-15,17-18H2,1H3,(H,28,31)/p+1