4-methylbenzenesulfonate; tris(4-methoxyphenyl)sulfanium

Systemtic Name: 4-methylbenzenesulfonate; tris(4-methoxyphenyl)sulfanium Openeye Name: 4-methylbenzenesulfonate; tris(4-methoxyphenyl)sulfonium CAS Name: 4-methylbenzenesulfonate; tris(4-methoxyphenyl)sulfonium IUPAC Name: 4-methylbenzenesulfonate; tris(4-methoxyphenyl)sulfanium Traditional Name: tris(4-methoxyphenyl)sulfonium tosylate Formula: C28H28O6S2 MolecularWeight: 524.64832

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C21H21O3S.C7H8O3S/c1-22-16-4-10-19(11-5-16)25(20-12-6-17(23-2)7-13-20)21-14-8-18(24-3)9-15-21;1-6-2-4-7(5-3-6)11(8,9)10/h4-15H,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1