(3,4-dimethylphenyl) 4-[4-(4-methylphenyl)sulfonylphenyl]benzenesulfonate

Systemtic Name: (3,4-dimethylphenyl) 4-[4-(4-methylphenyl)sulfonylphenyl]benzenesulfonate Openeye Name: (3,4-dimethylphenyl) 4-[4-(p-tolylsulfonyl)phenyl]benzenesulfonate CAS Name: 4-[4-(4-methylphenyl)sulfonylphenyl]benzenesulfonic acid (3,4-dimethylphenyl) ester IUPAC Name: (3,4-dimethylphenyl) 4-[4-(4-methylphenyl)sulfonylphenyl]benzenesulfonate Traditional Name: 4-(4-tosylphenyl)benzenesulfonic acid (3,4-dimethylphenyl) ester Formula: C27H24O5S2 MolecularWeight: 492.60646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)OC4=CC(=C(C=C4)C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)S(=O)(=O)OC4=CC(=C(C=C4)C)C

InChI

InChI=1S/C27H24O5S2/c1-19-4-12-25(13-5-19)33(28,29)26-14-7-22(8-15-26)23-9-16-27(17-10-23)34(30,31)32-24-11-6-20(2)21(3)18-24/h4-18H,1-3H3