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

Systemtic Name: bis(4-methoxyphenyl)-phenyl-sulfanium; 4-methylbenzenesulfonate Openeye Name: bis(4-methoxyphenyl)-phenyl-sulfonium; 4-methylbenzenesulfonate CAS Name: bis(4-methoxyphenyl)-phenylsulfonium; 4-methylbenzenesulfonate IUPAC Name: bis(4-methoxyphenyl)-phenylsulfanium; 4-methylbenzenesulfonate Traditional Name: bis(4-methoxyphenyl)-phenyl-sulfonium tosylate Formula: C27H26O5S2 MolecularWeight: 494.62234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].COC1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].COC1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H19O2S.C7H8O3S/c1-21-16-8-12-19(13-9-16)23(18-6-4-3-5-7-18)20-14-10-17(22-2)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