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

Systemtic Name: N-(2-bromanyl-4-sulfamoyl-phenyl)-2-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)ethanamide perchlorate Openeye Name: N-(2-bromo-4-sulfamoyl-phenyl)-2-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)acetamide perchlorate CAS Name: N-(2-bromo-4-sulfamoylphenyl)-2-(2,6-dimethyl-4-phenyl-1-pyridin-1-iumyl)acetamide perchlorate IUPAC Name: N-(2-bromo-4-sulfamoylphenyl)-2-(2,6-dimethyl-4-phenylpyridin-1-ium-1-yl)acetamide perchlorate Traditional Name: N-(2-bromo-4-sulfamoyl-phenyl)-2-(2,6-dimethyl-4-phenyl-pyridin-1-ium-1-yl)acetamide perchlorate Formula: C21H21BrClN3O7S MolecularWeight: 574.82934

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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)Br)C)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC(=CC(=[N+]1CC(=O)NC2=C(C=C(C=C2)S(=O)(=O)N)Br)C)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C21H20BrN3O3S.ClHO4/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;2-1(3,4)5/h3-12H,13H2,1-2H3,(H2-,23,24,26,27,28);(H,2,3,4,5)