4-(2-oxidanylidenepyrrolidin-1-yl)-N-(2-pyrrolidin-1-ium-1-ylethyl)benzenesulfonamide

Systemtic Name: 4-(2-oxidanylidenepyrrolidin-1-yl)-N-(2-pyrrolidin-1-ium-1-ylethyl)benzenesulfonamide Openeye Name: 4-(2-oxopyrrolidin-1-yl)-N-(2-pyrrolidin-1-ium-1-ylethyl)benzenesulfonamide CAS Name: 4-(2-oxo-1-pyrrolidinyl)-N-[2-(1-pyrrolidin-1-iumyl)ethyl]benzenesulfonamide IUPAC Name: 4-(2-oxopyrrolidin-1-yl)-N-(2-pyrrolidin-1-ium-1-ylethyl)benzenesulfonamide Traditional Name: 4-(2-ketopyrrolidino)-N-(2-pyrrolidin-1-ium-1-ylethyl)benzenesulfonamide Formula: C16H24N3O3S+ MolecularWeight: 338.44506

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCNS(=O)(=O)C2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

C1CC[NH+](C1)CCNS(=O)(=O)C2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C16H23N3O3S/c20-16-4-3-12-19(16)14-5-7-15(8-6-14)23(21,22)17-9-13-18-10-1-2-11-18/h5-8,17H,1-4,9-13H2/p+1