4,5-dimethoxy-2-methyl-N-[(2R)-2-pyrrolidin-1-ium-1-ylbutyl]benzenesulfonamide

Systemtic Name: 4,5-dimethoxy-2-methyl-N-[(2R)-2-pyrrolidin-1-ium-1-ylbutyl]benzenesulfonamide Openeye Name: 4,5-dimethoxy-2-methyl-N-[(2R)-2-pyrrolidin-1-ium-1-ylbutyl]benzenesulfonamide CAS Name: 4,5-dimethoxy-2-methyl-N-[(2R)-2-(1-pyrrolidin-1-iumyl)butyl]benzenesulfonamide IUPAC Name: 4,5-dimethoxy-2-methyl-N-[(2R)-2-pyrrolidin-1-ium-1-ylbutyl]benzenesulfonamide Traditional Name: 4,5-dimethoxy-2-methyl-N-[(2R)-2-pyrrolidin-1-ium-1-ylbutyl]benzenesulfonamide Formula: C17H29N2O4S+ MolecularWeight: 357.48816

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNS(=O)(=O)C1=CC(=C(C=C1C)OC)OC)[NH+]2CCCC2

Isomeric SMILES

CC[C@H](CNS(=O)(=O)C1=CC(=C(C=C1C)OC)OC)[NH+]2CCCC2

InChI

InChI=1S/C17H28N2O4S/c1-5-14(19-8-6-7-9-19)12-18-24(20,21)17-11-16(23-4)15(22-3)10-13(17)2/h10-11,14,18H,5-9,12H2,1-4H3/p+1/t14-/m1/s1