sodium bis(2-ethylhexa-3,5-diynyl) 2-oxidanidylperoxysulfanylbutanedioate

Systemtic Name: sodium bis(2-ethylhexa-3,5-diynyl) 2-oxidanidylperoxysulfanylbutanedioate Openeye Name: sodium bis(2-ethylhexa-3,5-diynyl) 2-oxidoperoxysulfanylbutanedioate CAS Name: sodium 2-(oxidodioxythio)butanedioic acid bis(2-ethylhexa-3,5-diynyl) ester IUPAC Name: sodium bis(2-ethylhexa-3,5-diynyl) 2-oxidoperoxysulfanylbutanedioate Traditional Name: sodium 2-(oxidoperoxythio)succinic acid bis(2-ethylhexa-3,5-diynyl) ester Formula: C20H21NaO7S MolecularWeight: 428.43131

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC(=O)CC(C(=O)OCC(CC)C#CC#C)SOO[O-])C#CC#C.[Na+]

Isomeric SMILES

CCC(COC(=O)CC(C(=O)OCC(CC)C#CC#C)SOO[O-])C#CC#C.[Na+]

InChI

InChI=1S/C20H22O7S.Na/c1-5-9-11-16(7-3)14-24-19(21)13-18(28-27-26-23)20(22)25-15-17(8-4)12-10-6-2;/h1-2,16-18,23H,7-8,13-15H2,3-4H3;/q;+1/p-1