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

Systemtic Name: dipropan-2-yl 2,5-bis-(4-methylphenyl)sulfonyl-3,6-bis(oxidanylidene)cyclohexa-1,4-diene-1,4-dicarboxylate Openeye Name: diisopropyl 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 dipropan-2-yl ester IUPAC Name: dipropan-2-yl 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 diisopropyl ester Formula: C28H28O10S2 MolecularWeight: 588.64592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H28O10S2/c1-15(2)37-27(31)21-23(29)26(40(35,36)20-13-9-18(6)10-14-20)22(28(32)38-16(3)4)24(30)25(21)39(33,34)19-11-7-17(5)8-12-19/h7-16H,1-6H3