bis(4-methylphenyl)-phenyl-sulfanium; 4-methylbenzenesulfonate

Systemtic Name: bis(4-methylphenyl)-phenyl-sulfanium; 4-methylbenzenesulfonate Openeye Name: 4-methylbenzenesulfonate; phenyl(bis-p-tolyl)sulfonium CAS Name: bis(4-methylphenyl)-phenylsulfonium; 4-methylbenzenesulfonate IUPAC Name: bis(4-methylphenyl)-phenylsulfanium; 4-methylbenzenesulfonate Traditional Name: phenyl(bis-p-tolyl)sulfonium tosylate Formula: C27H26O3S2 MolecularWeight: 462.62354

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.CC1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C20H19S.C7H8O3S/c1-16-8-12-19(13-9-16)21(18-6-4-3-5-7-18)20-14-10-17(2)11-15-20;1-6-2-4-7(5-3-6)11(8,9)10/h3-15H,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1