[4-[4-[4-[4-bis(2,4-dimethylphenyl)sulfoniophenoxy]phenyl]iodoniophenoxy]phenyl]-bis(2,4-dimethylphenyl)sulfanium triperchlorate

Systemtic Name: [4-[4-[4-[4-bis(2,4-dimethylphenyl)sulfoniophenoxy]phenyl]iodoniophenoxy]phenyl]-bis(2,4-dimethylphenyl)sulfanium triperchlorate Openeye Name: [4-[4-[4-[4-bis(2,4-dimethylphenyl)sulfoniophenoxy]phenyl]iodoniophenoxy]phenyl]-bis(2,4-dimethylphenyl)sulfonium triperchlorate CAS Name: [4-[4-[4-[4-bis(2,4-dimethylphenyl)sulfoniophenoxy]phenyl]iodoniophenoxy]phenyl]-bis(2,4-dimethylphenyl)sulfonium triperchlorate IUPAC Name: [4-[4-[4-[4-bis(2,4-dimethylphenyl)sulfoniophenoxy]phenyl]iodoniophenoxy]phenyl]-bis(2,4-dimethylphenyl)sulfanium triperchlorate Traditional Name: [4-[4-[4-[4-bis(2,4-dimethylphenyl)sulfoniophenoxy]phenyl]iodoniophenoxy]phenyl]-bis(2,4-dimethylphenyl)sulfonium triperchlorate Formula: C56H52Cl3IO14S2 MolecularWeight: 1246.39715

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[S+](C2=CC=C(C=C2)OC3=CC=C(C=C3)[I+]C4=CC=C(C=C4)OC5=CC=C(C=C5)[S+](C6=C(C=C(C=C6)C)C)C7=C(C=C(C=C7)C)C)C8=C(C=C(C=C8)C)C)C.[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)OC3=CC=C(C=C3)[I+]C4=CC=C(C=C4)OC5=CC=C(C=C5)[S+](C6=C(C=C(C=C6)C)C)C7=C(C=C(C=C7)C)C)C8=C(C=C(C=C8)C)C)C.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C56H52IO2S2.3ClHO4/c1-37-9-29-53(41(5)33-37)60(54-30-10-38(2)34-42(54)6)51-25-21-49(22-26-51)58-47-17-13-45(14-18-47)57-46-15-19-48(20-16-46)59-50-23-27-52(28-24-50)61(55-31-11-39(3)35-43(55)7)56-32-12-40(4)36-44(56)8;3*2-1(3,4)5/h9-36H,1-8H3;3*(H,2,3,4,5)/q+3;;;/p-3