N-[(2,4-dimethoxyphenyl)methyl]-3-[(3R)-1-(phenylmethyl)piperidin-1-ium-3-yl]propanamide

Systemtic Name: N-[(2,4-dimethoxyphenyl)methyl]-3-[(3R)-1-(phenylmethyl)piperidin-1-ium-3-yl]propanamide Openeye Name: 3-[(3R)-1-benzylpiperidin-1-ium-3-yl]-N-[(2,4-dimethoxyphenyl)methyl]propanamide CAS Name: N-[(2,4-dimethoxyphenyl)methyl]-3-[(3R)-1-(phenylmethyl)-3-piperidin-1-iumyl]propanamide IUPAC Name: 3-[(3R)-1-benzylpiperidin-1-ium-3-yl]-N-[(2,4-dimethoxyphenyl)methyl]propanamide Traditional Name: 3-[(3R)-1-benzylpiperidin-1-ium-3-yl]-N-(2,4-dimethoxybenzyl)propionamide Formula: C24H33N2O3+ MolecularWeight: 397.53042

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CNC(=O)CCC2CCC[NH+](C2)CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)CNC(=O)CC[C@H]2CCC[NH+](C2)CC3=CC=CC=C3)OC

InChI

InChI=1S/C24H32N2O3/c1-28-22-12-11-21(23(15-22)29-2)16-25-24(27)13-10-20-9-6-14-26(18-20)17-19-7-4-3-5-8-19/h3-5,7-8,11-12,15,20H,6,9-10,13-14,16-18H2,1-2H3,(H,25,27)/p+1/t20-/m1/s1