4-tert-butyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide

Systemtic Name: 4-tert-butyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide Openeye Name: 4-tert-butyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide CAS Name: 4-tert-butyl-N-[3-(1-pyrrolidin-1-iumyl)propyl]benzenesulfonamide IUPAC Name: 4-tert-butyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide Traditional Name: 4-tert-butyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide Formula: C17H29N2O2S+ MolecularWeight: 325.48936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H28N2O2S/c1-17(2,3)15-7-9-16(10-8-15)22(20,21)18-11-6-14-19-12-4-5-13-19/h7-10,18H,4-6,11-14H2,1-3H3/p+1