sodium bis(2-ethylhexyl) 5-oxidanidylperoxysulfanylbenzene-1,3-dicarboxylate

Systemtic Name: sodium bis(2-ethylhexyl) 5-oxidanidylperoxysulfanylbenzene-1,3-dicarboxylate Openeye Name: sodium bis(2-ethylhexyl) 5-oxidoperoxysulfanylbenzene-1,3-dicarboxylate CAS Name: sodium 5-(oxidodioxythio)benzene-1,3-dicarboxylic acid bis(2-ethylhexyl) ester IUPAC Name: sodium bis(2-ethylhexyl) 5-oxidoperoxysulfanylbenzene-1,3-dicarboxylate Traditional Name: sodium 5-(oxidoperoxythio)benzene-1,3-dicarboxylic acid bis(2-ethylhexyl) ester Formula: C24H37NaO7S MolecularWeight: 492.60115

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C1=CC(=CC(=C1)SOO[O-])C(=O)OCC(CC)CCCC.[Na+]

Isomeric SMILES

CCCCC(CC)COC(=O)C1=CC(=CC(=C1)SOO[O-])C(=O)OCC(CC)CCCC.[Na+]

InChI

InChI=1S/C24H38O7S.Na/c1-5-9-11-18(7-3)16-28-23(25)20-13-21(15-22(14-20)32-31-30-27)24(26)29-17-19(8-4)12-10-6-2;/h13-15,18-19,27H,5-12,16-17H2,1-4H3;/q;+1/p-1