2-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]-N-phenethyl-ethanamide

Systemtic Name: 2-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]-N-phenethyl-ethanamide Openeye Name: 2-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]-N-phenethyl-acetamide CAS Name: 2-[(2R)-2-(2,4-dimethoxyphenyl)-1-pyrrolidin-1-iumyl]-N-phenethylacetamide IUPAC Name: 2-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]-N-phenethylacetamide Traditional Name: 2-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]-N-phenethyl-acetamide Formula: C22H29N2O3+ MolecularWeight: 369.47726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2CCC[NH+]2CC(=O)NCCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)[C@H]2CCC[NH+]2CC(=O)NCCC3=CC=CC=C3)OC

InChI

InChI=1S/C22H28N2O3/c1-26-18-10-11-19(21(15-18)27-2)20-9-6-14-24(20)16-22(25)23-13-12-17-7-4-3-5-8-17/h3-5,7-8,10-11,15,20H,6,9,12-14,16H2,1-2H3,(H,23,25)/p+1/t20-/m1/s1