N-[1-(3-hydroxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-N-methyl-2-[2-(methylsulfonylamino)phenyl]ethanamide

Systemtic Name: N-[1-(3-hydroxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-N-methyl-2-[2-(methylsulfonylamino)phenyl]ethanamide Openeye Name: N-[1-(3-hydroxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-[2-(methanesulfonamido)phenyl]-N-methyl-acetamide CAS Name: N-[1-(3-hydroxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-2-[2-(methanesulfonamido)phenyl]-N-methylacetamide IUPAC Name: N-[1-(3-hydroxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-2-[2-(methanesulfonamido)phenyl]-N-methylacetamide Traditional Name: N-[1-(3-hydroxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-[2-(methanesulfonamido)phenyl]-N-methyl-acetamide Formula: C22H30N3O4S+ MolecularWeight: 432.5563

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(C[NH+]1CCCC1)C2=CC(=CC=C2)O)C(=O)CC3=CC=CC=C3NS(=O)(=O)C

Isomeric SMILES

CN(C(C[NH+]1CCCC1)C2=CC(=CC=C2)O)C(=O)CC3=CC=CC=C3NS(=O)(=O)C

InChI

InChI=1S/C22H29N3O4S/c1-24(22(27)15-17-8-3-4-11-20(17)23-30(2,28)29)21(16-25-12-5-6-13-25)18-9-7-10-19(26)14-18/h3-4,7-11,14,21,23,26H,5-6,12-13,15-16H2,1-2H3/p+1