2-[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-ium-1-yl]-N-(3-methylsulfonylphenyl)ethanamide

Systemtic Name: 2-[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-ium-1-yl]-N-(3-methylsulfonylphenyl)ethanamide Openeye Name: 2-[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-ium-1-yl]-N-(3-methylsulfonylphenyl)acetamide CAS Name: 2-[(2R)-2-(4-methoxyphenyl)-1-pyrrolidin-1-iumyl]-N-(3-methylsulfonylphenyl)acetamide IUPAC Name: 2-[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-ium-1-yl]-N-(3-methylsulfonylphenyl)acetamide Traditional Name: N-(3-mesylphenyl)-2-[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-ium-1-yl]acetamide Formula: C20H25N2O4S+ MolecularWeight: 389.4885

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCC[NH+]2CC(=O)NC3=CC(=CC=C3)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)[C@H]2CCC[NH+]2CC(=O)NC3=CC(=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C20H24N2O4S/c1-26-17-10-8-15(9-11-17)19-7-4-12-22(19)14-20(23)21-16-5-3-6-18(13-16)27(2,24)25/h3,5-6,8-11,13,19H,4,7,12,14H2,1-2H3,(H,21,23)/p+1/t19-/m1/s1