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

Systemtic Name: N-[(3-methoxyphenyl)methyl]-3-[(3R)-1-[(2-prop-2-enoxyphenyl)methyl]piperidin-1-ium-3-yl]propanamide Openeye Name: 3-[(3R)-1-[(2-allyloxyphenyl)methyl]piperidin-1-ium-3-yl]-N-[(3-methoxyphenyl)methyl]propanamide CAS Name: N-[(3-methoxyphenyl)methyl]-3-[(3R)-1-[(2-prop-2-enoxyphenyl)methyl]-3-piperidin-1-iumyl]propanamide IUPAC Name: N-[(3-methoxyphenyl)methyl]-3-[(3R)-1-[(2-prop-2-enoxyphenyl)methyl]piperidin-1-ium-3-yl]propanamide Traditional Name: 3-[(3R)-1-(2-allyloxybenzyl)piperidin-1-ium-3-yl]-N-m-anisyl-propionamide Formula: C26H35N2O3+ MolecularWeight: 423.5677

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)CCC2CCC[NH+](C2)CC3=CC=CC=C3OCC=C

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)CC[C@H]2CCC[NH+](C2)CC3=CC=CC=C3OCC=C

InChI

InChI=1S/C26H34N2O3/c1-3-16-31-25-12-5-4-10-23(25)20-28-15-7-9-21(19-28)13-14-26(29)27-18-22-8-6-11-24(17-22)30-2/h3-6,8,10-12,17,21H,1,7,9,13-16,18-20H2,2H3,(H,27,29)/p+1/t21-/m1/s1