[4-(4-iodaniumylphenyl)phenyl]-bis(4-methylphenyl)sulfanium triperchlorate

Systemtic Name: [4-(4-iodaniumylphenyl)phenyl]-bis(4-methylphenyl)sulfanium triperchlorate Openeye Name: [4-(4-iodoniophenyl)phenyl]-bis(p-tolyl)sulfonium triperchlorate CAS Name: [4-(4-iodoniophenyl)phenyl]-bis(4-methylphenyl)sulfonium triperchlorate IUPAC Name: [4-(4-iodoniophenyl)phenyl]-bis(4-methylphenyl)sulfanium triperchlorate Traditional Name: [4-(4-iodoniophenyl)phenyl]-bis(p-tolyl)sulfonium triperchlorate Formula: C26H23Cl3IO12S- MolecularWeight: 792.78209

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)[S+](C2=CC=C(C=C2)C)C3=CC=C(C=C3)C4=CC=C(C=C4)[IH+].[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O

Isomeric SMILES

CC1=CC=C(C=C1)[S+](C2=CC=C(C=C2)C)C3=CC=C(C=C3)C4=CC=C(C=C4)[IH+].[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C26H23IS.3ClHO4/c1-19-3-13-24(14-4-19)28(25-15-5-20(2)6-16-25)26-17-9-22(10-18-26)21-7-11-23(27)12-8-21;3*2-1(3,4)5/h3-18,27H,1-2H3;3*(H,2,3,4,5)/q+2;;;/p-3