methanesulfonate; tris(4-methylphenyl)sulfanium

Systemtic Name: methanesulfonate; tris(4-methylphenyl)sulfanium Openeye Name: methanesulfonate; tris-p-tolylsulfonium CAS Name: methanesulfonate; tris(4-methylphenyl)sulfonium IUPAC Name: methanesulfonate; tris(4-methylphenyl)sulfanium Traditional Name: tris-p-tolylsulfonium mesylate Formula: C22H24O3S2 MolecularWeight: 400.55416

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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)C.CS(=O)(=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H21S.CH4O3S/c1-16-4-10-19(11-5-16)22(20-12-6-17(2)7-13-20)21-14-8-18(3)9-15-21;1-5(2,3)4/h4-15H,1-3H3;1H3,(H,2,3,4)/q+1;/p-1