N-(3-cyanothiophen-2-yl)-2-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-cyanothiophen-2-yl)-2-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]ethanamide Openeye Name: N-(3-cyano-2-thienyl)-2-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]acetamide CAS Name: N-(3-cyano-2-thiophenyl)-2-[(2R)-2-(2,4-dimethoxyphenyl)-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-(3-cyanothiophen-2-yl)-2-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]acetamide Traditional Name: N-(3-cyano-2-thienyl)-2-[(2R)-2-(2,4-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]acetamide Formula: C19H22N3O3S+ MolecularWeight: 372.46128

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2CCC[NH+]2CC(=O)NC3=C(C=CS3)C#N)OC

Isomeric SMILES

COC1=CC(=C(C=C1)[C@H]2CCC[NH+]2CC(=O)NC3=C(C=CS3)C#N)OC

InChI

InChI=1S/C19H21N3O3S/c1-24-14-5-6-15(17(10-14)25-2)16-4-3-8-22(16)12-18(23)21-19-13(11-20)7-9-26-19/h5-7,9-10,16H,3-4,8,12H2,1-2H3,(H,21,23)/p+1/t16-/m1/s1