N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-4-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonamide

Systemtic Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-4-(2-oxidanylidenepyrrolidin-1-yl)benzenesulfonamide Openeye Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide CAS Name: N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]-4-(2-oxo-1-pyrrolidinyl)benzenesulfonamide IUPAC Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide Traditional Name: 4-(2-ketopyrrolidino)-N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzenesulfonamide Formula: C21H27N4O3S+ MolecularWeight: 415.52908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)N4CCCC4=O

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)N4CCCC4=O

InChI

InChI=1S/C21H26N4O3S/c1-23-13-15-24(16-14-23)18-6-4-17(5-7-18)22-29(27,28)20-10-8-19(9-11-20)25-12-2-3-21(25)26/h4-11,22H,2-3,12-16H2,1H3/p+1