2,3,4,5,6-pentamethyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide

Systemtic Name: 2,3,4,5,6-pentamethyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide Openeye Name: 2,3,4,5,6-pentamethyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide CAS Name: 2,3,4,5,6-pentamethyl-N-[3-(1-pyrrolidin-1-iumyl)propyl]benzenesulfonamide IUPAC Name: 2,3,4,5,6-pentamethyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide Traditional Name: 2,3,4,5,6-pentamethyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide Formula: C18H31N2O2S+ MolecularWeight: 339.51594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)NCCC[NH+]2CCCC2)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1C)C)S(=O)(=O)NCCC[NH+]2CCCC2)C)C

InChI

InChI=1S/C18H30N2O2S/c1-13-14(2)16(4)18(17(5)15(13)3)23(21,22)19-9-8-12-20-10-6-7-11-20/h19H,6-12H2,1-5H3/p+1