2-[4-phenyl-2,6-di(propan-2-yl)pyridin-1-ium-1-yl]-N-(3-sulfamoylphenyl)ethanamide perchlorate

Systemtic Name: 2-[4-phenyl-2,6-di(propan-2-yl)pyridin-1-ium-1-yl]-N-(3-sulfamoylphenyl)ethanamide perchlorate Openeye Name: 2-(2,6-diisopropyl-4-phenyl-pyridin-1-ium-1-yl)-N-(3-sulfamoylphenyl)acetamide perchlorate CAS Name: 2-[4-phenyl-2,6-di(propan-2-yl)-1-pyridin-1-iumyl]-N-(3-sulfamoylphenyl)acetamide perchlorate IUPAC Name: 2-[4-phenyl-2,6-di(propan-2-yl)pyridin-1-ium-1-yl]-N-(3-sulfamoylphenyl)acetamide perchlorate Traditional Name: 2-(2,6-diisopropyl-4-phenyl-pyridin-1-ium-1-yl)-N-(3-sulfamoylphenyl)acetamide perchlorate Formula: C25H30ClN3O7S MolecularWeight: 552.0396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC(=CC(=[N+]1CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N)C(C)C)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC(C)C1=CC(=CC(=[N+]1CC(=O)NC2=CC(=CC=C2)S(=O)(=O)N)C(C)C)C3=CC=CC=C3.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C25H29N3O3S.ClHO4/c1-17(2)23-13-20(19-9-6-5-7-10-19)14-24(18(3)4)28(23)16-25(29)27-21-11-8-12-22(15-21)32(26,30)31;2-1(3,4)5/h5-15,17-18H,16H2,1-4H3,(H2-,26,27,29,30,31);(H,2,3,4,5)