3-[1-[[3-(ethoxymethyl)-4-methoxy-phenyl]methyl]piperidin-1-ium-4-yl]-N-(pyridin-3-ylmethyl)propanamide

Systemtic Name: 3-[1-[[3-(ethoxymethyl)-4-methoxy-phenyl]methyl]piperidin-1-ium-4-yl]-N-(pyridin-3-ylmethyl)propanamide Openeye Name: 3-[1-[[3-(ethoxymethyl)-4-methoxy-phenyl]methyl]piperidin-1-ium-4-yl]-N-(3-pyridylmethyl)propanamide CAS Name: 3-[1-[[3-(ethoxymethyl)-4-methoxyphenyl]methyl]-4-piperidin-1-iumyl]-N-(3-pyridinylmethyl)propanamide IUPAC Name: 3-[1-[[3-(ethoxymethyl)-4-methoxyphenyl]methyl]piperidin-1-ium-4-yl]-N-(pyridin-3-ylmethyl)propanamide Traditional Name: 3-[1-[3-(ethoxymethyl)-4-methoxy-benzyl]piperidin-1-ium-4-yl]-N-(3-pyridylmethyl)propionamide Formula: C25H36N3O3+ MolecularWeight: 426.57164

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=C(C=CC(=C1)C[NH+]2CCC(CC2)CCC(=O)NCC3=CN=CC=C3)OC

Isomeric SMILES

CCOCC1=C(C=CC(=C1)C[NH+]2CCC(CC2)CCC(=O)NCC3=CN=CC=C3)OC

InChI

InChI=1S/C25H35N3O3/c1-3-31-19-23-15-21(6-8-24(23)30-2)18-28-13-10-20(11-14-28)7-9-25(29)27-17-22-5-4-12-26-16-22/h4-6,8,12,15-16,20H,3,7,9-11,13-14,17-19H2,1-2H3,(H,27,29)/p+1