1-[[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-N,N-dimethyl-6-oxidanylidene-pyridine-3-sulfonamide

Systemtic Name: 1-[[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-N,N-dimethyl-6-oxidanylidene-pyridine-3-sulfonamide Openeye Name: 1-[[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-N,N-dimethyl-6-oxo-pyridine-3-sulfonamide CAS Name: 1-[[(2R)-2-(2,5-dimethoxyphenyl)-1-pyrrolidin-1-iumyl]methyl]-N,N-dimethyl-6-oxo-3-pyridinesulfonamide IUPAC Name: 1-[[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-N,N-dimethyl-6-oxopyridine-3-sulfonamide Traditional Name: 1-[[(2R)-2-(2,5-dimethoxyphenyl)pyrrolidin-1-ium-1-yl]methyl]-6-keto-N,N-dimethyl-pyridine-3-sulfonamide Formula: C20H28N3O5S+ MolecularWeight: 422.51842

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CN(C(=O)C=C1)C[NH+]2CCCC2C3=C(C=CC(=C3)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C20H27N3O5S/c1-21(2)29(25,26)16-8-10-20(24)23(13-16)14-22-11-5-6-18(22)17-12-15(27-3)7-9-19(17)28-4/h7-10,12-13,18H,5-6,11,14H2,1-4H3/p+1/t18-/m1/s1