2,5-bis(bromanyl)-3,6-bis-(4-methylphenyl)sulfonyl-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2,5-bis(bromanyl)-3,6-bis-(4-methylphenyl)sulfonyl-cyclohexa-2,5-diene-1,4-dione Openeye Name: 2,5-dibromo-3,6-bis(p-tolylsulfonyl)-1,4-benzoquinone CAS Name: 2,5-dibromo-3,6-bis-(4-methylphenyl)sulfonylcyclohexa-2,5-diene-1,4-dione IUPAC Name: 2,5-dibromo-3,6-bis-(4-methylphenyl)sulfonylcyclohexa-2,5-diene-1,4-dione Traditional Name: 2,5-dibromo-3,6-ditosyl-p-benzoquinone Formula: C20H14Br2O6S2 MolecularWeight: 574.25956

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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)Br)S(=O)(=O)C3=CC=C(C=C3)C)Br

Isomeric SMILES

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

InChI

InChI=1S/C20H14Br2O6S2/c1-11-3-7-13(8-4-11)29(25,26)19-15(21)18(24)20(16(22)17(19)23)30(27,28)14-9-5-12(2)6-10-14/h3-10H,1-2H3