2-[(4-chlorophenyl)sulfonyl-methyl-amino]-N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]ethanamide

Systemtic Name: 2-[(4-chlorophenyl)sulfonyl-methyl-amino]-N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]ethanamide Openeye Name: 2-[(4-chlorophenyl)sulfonyl-methyl-amino]-N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]acetamide CAS Name: 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-[(2R)-2-(4-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]acetamide IUPAC Name: 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]acetamide Traditional Name: 2-[(4-chlorophenyl)sulfonyl-methyl-amino]-N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]acetamide Formula: C22H29ClN3O4S+ MolecularWeight: 467.00136

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NCC(C1=CC=C(C=C1)OC)[NH+]2CCCC2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CN(CC(=O)NC[C@@H](C1=CC=C(C=C1)OC)[NH+]2CCCC2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H28ClN3O4S/c1-25(31(28,29)20-11-7-18(23)8-12-20)16-22(27)24-15-21(26-13-3-4-14-26)17-5-9-19(30-2)10-6-17/h5-12,21H,3-4,13-16H2,1-2H3,(H,24,27)/p+1/t21-/m0/s1