sodium 2-oxidanidyloxysulfanyl-5-pentadecyl-benzene-1,4-diol

Systemtic Name: sodium 2-oxidanidyloxysulfanyl-5-pentadecyl-benzene-1,4-diol Openeye Name: sodium 2-oxidooxysulfanyl-5-pentadecyl-benzene-1,4-diol CAS Name: sodium 2,5-dihydroxy-4-pentadecylbenzenesulfenoperoxoate IUPAC Name: sodium 2-oxidooxysulfanyl-5-pentadecylbenzene-1,4-diol Traditional Name: sodium 2-(oxidooxythio)-5-pentadecyl-hydroquinone Formula: C21H35NaO4S MolecularWeight: 406.55497

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=CC(=C(C=C1O)SO[O-])O.[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCC1=CC(=C(C=C1O)SO[O-])O.[Na+]

InChI

InChI=1S/C21H36O4S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-16-20(23)21(26-25-24)17-19(18)22;/h16-17,22-24H,2-15H2,1H3;/q;+1/p-1