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

Systemtic Name: dicyclohexyl 2-(4-methylphenyl)sulfonyl-3,6-bis(oxidanylidene)cyclohexa-1,4-diene-1,4-dicarboxylate Openeye Name: dicyclohexyl 3,6-dioxo-2-(p-tolylsulfonyl)cyclohexa-1,4-diene-1,4-dicarboxylate CAS Name: 2-(4-methylphenyl)sulfonyl-3,6-dioxocyclohexa-1,4-diene-1,4-dicarboxylic acid dicyclohexyl ester IUPAC Name: dicyclohexyl 2-(4-methylphenyl)sulfonyl-3,6-dioxocyclohexa-1,4-diene-1,4-dicarboxylate Traditional Name: 3,6-diketo-2-tosyl-cyclohexa-1,4-diene-1,4-dicarboxylic acid dicyclohexyl ester Formula: C27H30O8S MolecularWeight: 514.5873

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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)OC3CCCCC3)C(=O)OC4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=C(C(=O)C=C(C2=O)C(=O)OC3CCCCC3)C(=O)OC4CCCCC4

InChI

InChI=1S/C27H30O8S/c1-17-12-14-20(15-13-17)36(32,33)25-23(27(31)35-19-10-6-3-7-11-19)22(28)16-21(24(25)29)26(30)34-18-8-4-2-5-9-18/h12-16,18-19H,2-11H2,1H3