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

Systemtic Name: 2,4,6-trimethyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide Openeye Name: 2,4,6-trimethyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide CAS Name: 2,4,6-trimethyl-N-[3-(1-pyrrolidin-1-iumyl)propyl]benzenesulfonamide IUPAC Name: 2,4,6-trimethyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide Traditional Name: 2,4,6-trimethyl-N-(3-pyrrolidin-1-ium-1-ylpropyl)benzenesulfonamide Formula: C16H27N2O2S+ MolecularWeight: 311.46278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)NCCC[NH+]2CCCC2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)NCCC[NH+]2CCCC2)C

InChI

InChI=1S/C16H26N2O2S/c1-13-11-14(2)16(15(3)12-13)21(19,20)17-7-6-10-18-8-4-5-9-18/h11-12,17H,4-10H2,1-3H3/p+1