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

Systemtic Name: dibutyl 2-(4-methylphenyl)sulfonyl-3,6-bis(oxidanylidene)cyclohexa-1,4-diene-1,4-dicarboxylate Openeye Name: dibutyl 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 dibutyl ester IUPAC Name: dibutyl 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 dibutyl ester Formula: C23H26O8S MolecularWeight: 462.51274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=O)C(=C(C1=O)S(=O)(=O)C2=CC=C(C=C2)C)C(=O)OCCCC

Isomeric SMILES

CCCCOC(=O)C1=CC(=O)C(=C(C1=O)S(=O)(=O)C2=CC=C(C=C2)C)C(=O)OCCCC

InChI

InChI=1S/C23H26O8S/c1-4-6-12-30-22(26)17-14-18(24)19(23(27)31-13-7-5-2)21(20(17)25)32(28,29)16-10-8-15(3)9-11-16/h8-11,14H,4-7,12-13H2,1-3H3