bis-(4-methylphenyl)sulfonyl benzene-1,3-dicarboxylate

Systemtic Name: bis-(4-methylphenyl)sulfonyl benzene-1,3-dicarboxylate Openeye Name: bis(p-tolylsulfonyl) benzene-1,3-dicarboxylate CAS Name: benzene-1,3-dicarboxylic acid bis-(4-methylphenyl)sulfonyl ester IUPAC Name: bis-(4-methylphenyl)sulfonyl benzene-1,3-dicarboxylate Traditional Name: benzene-1,3-dicarboxylic acid ditosyl ester Formula: C22H18O8S2 MolecularWeight: 474.50352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(=O)C2=CC(=CC=C2)C(=O)OS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC(=O)C2=CC(=CC=C2)C(=O)OS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H18O8S2/c1-15-6-10-19(11-7-15)31(25,26)29-21(23)17-4-3-5-18(14-17)22(24)30-32(27,28)20-12-8-16(2)9-13-20/h3-14H,1-2H3