N-[4-[2-(2,3,4,5-tetramethylimidazol-3-ium-1-yl)ethanoyl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[2-(2,3,4,5-tetramethylimidazol-3-ium-1-yl)ethanoyl]phenyl]methanesulfonamide Openeye Name: N-[4-[2-(2,3,4,5-tetramethylimidazol-3-ium-1-yl)acetyl]phenyl]methanesulfonamide CAS Name: N-[4-[1-oxo-2-(2,3,4,5-tetramethyl-1-imidazol-3-iumyl)ethyl]phenyl]methanesulfonamide IUPAC Name: N-[4-[2-(2,3,4,5-tetramethylimidazol-3-ium-1-yl)acetyl]phenyl]methanesulfonamide Traditional Name: N-[4-[2-(2,3,4,5-tetramethylimidazol-3-ium-1-yl)acetyl]phenyl]methanesulfonamide Formula: C16H22N3O3S+ MolecularWeight: 336.42918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](=C(N1CC(=O)C2=CC=C(C=C2)NS(=O)(=O)C)C)C)C

Isomeric SMILES

CC1=C([N+](=C(N1CC(=O)C2=CC=C(C=C2)NS(=O)(=O)C)C)C)C

InChI

InChI=1S/C16H21N3O3S/c1-11-12(2)19(13(3)18(11)4)10-16(20)14-6-8-15(9-7-14)17-23(5,21)22/h6-9H,10H2,1-5H3/p+1