2,5-bis(chloranyl)benzenesulfonate; bis(4-methylphenyl)-phenyl-sulfanium

Systemtic Name: 2,5-bis(chloranyl)benzenesulfonate; bis(4-methylphenyl)-phenyl-sulfanium Openeye Name: 2,5-dichlorobenzenesulfonate; phenyl(bis-p-tolyl)sulfonium CAS Name: bis(4-methylphenyl)-phenylsulfonium; 2,5-dichlorobenzenesulfonate IUPAC Name: bis(4-methylphenyl)-phenylsulfanium; 2,5-dichlorobenzenesulfonate Traditional Name: 2,5-dichlorobesylate; phenyl(bis-p-tolyl)sulfonium Formula: C26H22Cl2O3S2 MolecularWeight: 517.48708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=C(C=C3)C.C1=CC(=C(C=C1Cl)S(=O)(=O)[O-])Cl

Isomeric SMILES

CC1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=C(C=C3)C.C1=CC(=C(C=C1Cl)S(=O)(=O)[O-])Cl

InChI

InChI=1S/C20H19S.C6H4Cl2O3S/c1-16-8-12-19(13-9-16)21(18-6-4-3-5-7-18)20-14-10-17(2)11-15-20;7-4-1-2-5(8)6(3-4)12(9,10)11/h3-15H,1-2H3;1-3H,(H,9,10,11)/q+1;/p-1