2-(2-methoxyphenoxy)-N-[[(3R)-1-[(2-prop-2-enoxyphenyl)methyl]piperidin-1-ium-3-yl]methyl]ethanamide

Systemtic Name: 2-(2-methoxyphenoxy)-N-[[(3R)-1-[(2-prop-2-enoxyphenyl)methyl]piperidin-1-ium-3-yl]methyl]ethanamide Openeye Name: N-[[(3R)-1-[(2-allyloxyphenyl)methyl]piperidin-1-ium-3-yl]methyl]-2-(2-methoxyphenoxy)acetamide CAS Name: 2-(2-methoxyphenoxy)-N-[[(3R)-1-[(2-prop-2-enoxyphenyl)methyl]-3-piperidin-1-iumyl]methyl]acetamide IUPAC Name: 2-(2-methoxyphenoxy)-N-[[(3R)-1-[(2-prop-2-enoxyphenyl)methyl]piperidin-1-ium-3-yl]methyl]acetamide Traditional Name: N-[[(3R)-1-(2-allyloxybenzyl)piperidin-1-ium-3-yl]methyl]-2-(2-methoxyphenoxy)acetamide Formula: C25H33N2O4+ MolecularWeight: 425.54052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1OCC(=O)NCC2CCC[NH+](C2)CC3=CC=CC=C3OCC=C

Isomeric SMILES

COC1=CC=CC=C1OCC(=O)NC[C@H]2CCC[NH+](C2)CC3=CC=CC=C3OCC=C

InChI

InChI=1S/C25H32N2O4/c1-3-15-30-22-11-5-4-10-21(22)18-27-14-8-9-20(17-27)16-26-25(28)19-31-24-13-7-6-12-23(24)29-2/h3-7,10-13,20H,1,8-9,14-19H2,2H3,(H,26,28)/p+1/t20-/m1/s1