5-bromanyl-2-methoxy-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide

Systemtic Name: 5-bromanyl-2-methoxy-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide Openeye Name: 5-bromo-2-methoxy-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide CAS Name: 5-bromo-2-methoxy-N-[3-(1-pyrrolidin-1-iumyl)propyl]benzenesulfonamide IUPAC Name: 5-bromo-2-methoxy-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide Traditional Name: 5-bromo-2-methoxy-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide Formula: C14H22BrN2O3S+ MolecularWeight: 378.30508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)S(=O)(=O)NCCC[NH+]2CCCC2

Isomeric SMILES

COC1=C(C=C(C=C1)Br)S(=O)(=O)NCCC[NH+]2CCCC2

InChI

InChI=1S/C14H21BrN2O3S/c1-20-13-6-5-12(15)11-14(13)21(18,19)16-7-4-10-17-8-2-3-9-17/h5-6,11,16H,2-4,7-10H2,1H3/p+1