N-(3-pyrrolidin-1-ium-1-ylpropyl)-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-(3-pyrrolidin-1-ium-1-ylpropyl)-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide Openeye Name: N-(3-pyrrolidin-1-ium-1-ylpropyl)-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide CAS Name: N-[3-(1-pyrrolidin-1-iumyl)propyl]-4-(1-pyrrolidinylsulfonyl)benzenesulfonamide IUPAC Name: N-(3-pyrrolidin-1-ium-1-ylpropyl)-4-pyrrolidin-1-ylsulfonylbenzenesulfonamide Traditional Name: N-(3-pyrrolidin-1-ium-1-ylpropyl)-4-pyrrolidinosulfonyl-benzenesulfonamide Formula: C17H28N3O4S2+ MolecularWeight: 402.55192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27N3O4S2/c21-25(22,18-10-5-13-19-11-1-2-12-19)16-6-8-17(9-7-16)26(23,24)20-14-3-4-15-20/h6-9,18H,1-5,10-15H2/p+1