diethyl 2,5-bis-(4-methylphenyl)sulfonyl-3,6-bis(oxidanylidene)cyclohexa-1,4-diene-1,4-dicarboxylate

Systemtic Name: diethyl 2,5-bis-(4-methylphenyl)sulfonyl-3,6-bis(oxidanylidene)cyclohexa-1,4-diene-1,4-dicarboxylate Openeye Name: diethyl 3,6-dioxo-2,5-bis(p-tolylsulfonyl)cyclohexa-1,4-diene-1,4-dicarboxylate CAS Name: 2,5-bis-(4-methylphenyl)sulfonyl-3,6-dioxocyclohexa-1,4-diene-1,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2,5-bis-(4-methylphenyl)sulfonyl-3,6-dioxocyclohexa-1,4-diene-1,4-dicarboxylate Traditional Name: 3,6-diketo-2,5-ditosyl-cyclohexa-1,4-diene-1,4-dicarboxylic acid diethyl ester Formula: C26H24O10S2 MolecularWeight: 560.59276

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=O)C(=C(C1=O)S(=O)(=O)C2=CC=C(C=C2)C)C(=O)OCC)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C(=O)C(=C(C1=O)S(=O)(=O)C2=CC=C(C=C2)C)C(=O)OCC)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C26H24O10S2/c1-5-35-25(29)19-21(27)24(38(33,34)18-13-9-16(4)10-14-18)20(26(30)36-6-2)22(28)23(19)37(31,32)17-11-7-15(3)8-12-17/h7-14H,5-6H2,1-4H3