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

Systemtic Name: 2-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]acetamide CAS Name: 2-[(2R)-2-(2,4-dimethoxyphenyl)-1-pyrrolidin-1-iumyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]acetamide Traditional Name: N-benzyl-2-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]acetamide Formula: C21H27N2O3+ MolecularWeight: 355.45068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2CCC[NH+]2CC(=O)NCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=C(C=C1)[C@H]2CCC[NH+]2CC(=O)NCC3=CC=CC=C3)OC

InChI

InChI=1S/C21H26N2O3/c1-25-17-10-11-18(20(13-17)26-2)19-9-6-12-23(19)15-21(24)22-14-16-7-4-3-5-8-16/h3-5,7-8,10-11,13,19H,6,9,12,14-15H2,1-2H3,(H,22,24)/p+1/t19-/m1/s1