N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-[2-(methylsulfonylamino)ethyl]benzamide

Systemtic Name: N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-[2-(methylsulfonylamino)ethyl]benzamide Openeye Name: 4-[2-(methanesulfonamido)ethyl]-N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide CAS Name: 4-[2-(methanesulfonamido)ethyl]-N-[(2R)-2-(3-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]benzamide IUPAC Name: 4-[2-(methanesulfonamido)ethyl]-N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]benzamide Traditional Name: 4-[2-(methanesulfonamido)ethyl]-N-[(2R)-2-(3-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Formula: C23H32N3O4S+ MolecularWeight: 446.58288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CNC(=O)C2=CC=C(C=C2)CCNS(=O)(=O)C)[NH+]3CCCC3

Isomeric SMILES

COC1=CC=CC(=C1)[C@H](CNC(=O)C2=CC=C(C=C2)CCNS(=O)(=O)C)[NH+]3CCCC3

InChI

InChI=1S/C23H31N3O4S/c1-30-21-7-5-6-20(16-21)22(26-14-3-4-15-26)17-24-23(27)19-10-8-18(9-11-19)12-13-25-31(2,28)29/h5-11,16,22,25H,3-4,12-15,17H2,1-2H3,(H,24,27)/p+1/t22-/m0/s1