2-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)-N-(2-fluoranyl-4-sulfamoyl-phenyl)ethanamide

Systemtic Name: 2-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)-N-(2-fluoranyl-4-sulfamoyl-phenyl)ethanamide Openeye Name: 2-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)-N-(2-fluoro-4-sulfamoyl-phenyl)acetamide CAS Name: 2-(2,6-dimethyl-4-phenyl-1-pyridin-1-iumyl)-N-(2-fluoro-4-sulfamoylphenyl)acetamide IUPAC Name: 2-(2,6-dimethyl-4-phenylpyridin-1-ium-1-yl)-N-(2-fluoro-4-sulfamoylphenyl)acetamide Traditional Name: 2-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)-N-(2-fluoro-4-sulfamoyl-phenyl)acetamide Formula: C21H21FN3O3S+ MolecularWeight: 414.473143

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=[N+]1CC(=O)NC2=C(C=C(C=C2)S(=O)(=O)N)F)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC(=[N+]1CC(=O)NC2=C(C=C(C=C2)S(=O)(=O)N)F)C)C3=CC=CC=C3

InChI

InChI=1S/C21H20FN3O3S/c1-14-10-17(16-6-4-3-5-7-16)11-15(2)25(14)13-21(26)24-20-9-8-18(12-19(20)22)29(23,27)28/h3-12H,13H2,1-2H3,(H2-,23,24,26,27,28)/p+1