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

Systemtic Name: N-(3-piperidin-1-ium-1-ylpropyl)-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide Openeye Name: N-(3-piperidin-1-ium-1-ylpropyl)-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide CAS Name: N-[3-(1-piperidin-1-iumyl)propyl]-4-(1-pyrrolidinylsulfonyl)benzenesulfonamide IUPAC Name: N-(3-piperidin-1-ium-1-ylpropyl)-4-pyrrolidin-1-ylsulfonylbenzenesulfonamide Traditional Name: N-(3-piperidin-1-ium-1-ylpropyl)-4-pyrrolidinosulfonyl-benzenesulfonamide Formula: C18H30N3O4S2+ MolecularWeight: 416.5785

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCNS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

C1CC[NH+](CC1)CCCNS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C18H29N3O4S2/c22-26(23,19-11-6-14-20-12-2-1-3-13-20)17-7-9-18(10-8-17)27(24,25)21-15-4-5-16-21/h7-10,19H,1-6,11-16H2/p+1