4-bromanyl-N-(2-pyrrolidin-1-ium-1-ylethyl)benzenesulfonamide

Systemtic Name: 4-bromanyl-N-(2-pyrrolidin-1-ium-1-ylethyl)benzenesulfonamide Openeye Name: 4-bromo-N-(2-pyrrolidin-1-ium-1-ylethyl)benzenesulfonamide CAS Name: 4-bromo-N-[2-(1-pyrrolidin-1-iumyl)ethyl]benzenesulfonamide IUPAC Name: 4-bromo-N-(2-pyrrolidin-1-ium-1-ylethyl)benzenesulfonamide Traditional Name: 4-bromo-N-(2-pyrrolidin-1-ium-1-ylethyl)benzenesulfonamide Formula: C12H18BrN2O2S+ MolecularWeight: 334.25252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17BrN2O2S/c13-11-3-5-12(6-4-11)18(16,17)14-7-10-15-8-1-2-9-15/h3-6,14H,1-2,7-10H2/p+1