disodium 5-[(3-azanyl-4-oxidanidylperoxysulfanyl-phenyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: disodium 5-[(3-azanyl-4-oxidanidylperoxysulfanyl-phenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: disodium 5-(3-amino-4-oxidoperoxysulfanyl-anilino)-5-oxo-pentanoate CAS Name: disodium 5-[3-amino-4-(oxidodioxythio)anilino]-5-oxopentanoate IUPAC Name: disodium 5-(3-amino-4-oxidoperoxysulfanylanilino)-5-oxopentanoate Traditional Name: disodium 5-[3-amino-4-(oxidoperoxythio)anilino]-5-keto-valerate Formula: C11H12N2Na2O6S MolecularWeight: 346.26732

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)CCCC(=O)[O-])N)SOO[O-].[Na+].[Na+]

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)CCCC(=O)[O-])N)SOO[O-].[Na+].[Na+]

InChI

InChI=1S/C11H14N2O6S.2Na/c12-8-6-7(4-5-9(8)20-19-18-17)13-10(14)2-1-3-11(15)16;;/h4-6,17H,1-3,12H2,(H,13,14)(H,15,16);;/q;2*+1/p-2