4-(4-methylphenyl)sulfonyloxybenzenesulfonate; triphenylsulfanium

Systemtic Name: 4-(4-methylphenyl)sulfonyloxybenzenesulfonate; triphenylsulfanium Openeye Name: 4-(p-tolylsulfonyloxy)benzenesulfonate; triphenylsulfonium CAS Name: 4-(4-methylphenyl)sulfonyloxybenzenesulfonate; triphenylsulfonium IUPAC Name: 4-(4-methylphenyl)sulfonyloxybenzenesulfonate; triphenylsulfanium Traditional Name: 4-tosyloxybesylate; triphenylsulfonium Formula: C31H26O6S3 MolecularWeight: 590.72954

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)S(=O)(=O)[O-].C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)S(=O)(=O)[O-].C1=CC=C(C=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C18H15S.C13H12O6S2/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-10-2-6-13(7-3-10)21(17,18)19-11-4-8-12(9-5-11)20(14,15)16/h1-15H;2-9H,1H3,(H,14,15,16)/q+1;/p-1