N-[4-[2-(2,3-dimethylimidazol-3-ium-1-yl)-1-oxidanyl-ethyl]phenyl]methanesulfonamide chloride

Systemtic Name: N-[4-[2-(2,3-dimethylimidazol-3-ium-1-yl)-1-oxidanyl-ethyl]phenyl]methanesulfonamide chloride Openeye Name: N-[4-[2-(2,3-dimethylimidazol-3-ium-1-yl)-1-hydroxy-ethyl]phenyl]methanesulfonamide chloride CAS Name: N-[4-[2-(2,3-dimethyl-1-imidazol-3-iumyl)-1-hydroxyethyl]phenyl]methanesulfonamide chloride IUPAC Name: N-[4-[2-(2,3-dimethylimidazol-3-ium-1-yl)-1-hydroxyethyl]phenyl]methanesulfonamide chloride Traditional Name: N-[4-[2-(2,3-dimethylimidazol-3-ium-1-yl)-1-hydroxy-ethyl]phenyl]methanesulfonamide chloride Formula: C14H20ClN3O3S MolecularWeight: 345.8449

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C=CN1CC(C2=CC=C(C=C2)NS(=O)(=O)C)O)C.[Cl-]

Isomeric SMILES

CC1=[N+](C=CN1CC(C2=CC=C(C=C2)NS(=O)(=O)C)O)C.[Cl-]

InChI

InChI=1S/C14H20N3O3S.ClH/c1-11-16(2)8-9-17(11)10-14(18)12-4-6-13(7-5-12)15-21(3,19)20;/h4-9,14-15,18H,10H2,1-3H3;1H/q+1;/p-1