tetrasodium 7-oxidanidylperoxysulfanyl-3-[[4-[(3-oxidanidylperoxysulfanyl-6-sulfonato-naphthalen-2-yl)carbamoyl]phenyl]carbonylamino]naphthalene-2-sulfonate

Systemtic Name: tetrasodium 7-oxidanidylperoxysulfanyl-3-[[4-[(3-oxidanidylperoxysulfanyl-6-sulfonato-naphthalen-2-yl)carbamoyl]phenyl]carbonylamino]naphthalene-2-sulfonate Openeye Name: tetrasodium 7-oxidoperoxysulfanyl-3-[[4-[(3-oxidoperoxysulfanyl-6-sulfonato-2-naphthyl)carbamoyl]benzoyl]amino]naphthalene-2-sulfonate CAS Name: tetrasodium 7-(oxidodioxythio)-3-[[[4-[[[3-(oxidodioxythio)-6-sulfonato-2-naphthalenyl]amino]-oxomethyl]phenyl]-oxomethyl]amino]-2-naphthalenesulfonate IUPAC Name: tetrasodium 7-oxidoperoxysulfanyl-3-[[4-[(3-oxidoperoxysulfanyl-6-sulfonatonaphthalen-2-yl)carbamoyl]benzoyl]amino]naphthalene-2-sulfonate Traditional Name: tetrasodium 7-(oxidoperoxythio)-3-[[4-[[3-(oxidoperoxythio)-6-sulfonato-2-naphthyl]carbamoyl]benzoyl]amino]naphthalene-2-sulfonate Formula: C28H16N2Na4O14S4 MolecularWeight: 824.65072

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=C(C=C3C=C(C=CC3=C2)S(=O)(=O)[O-])SOO[O-])C(=O)NC4=C(C=C5C=C(C=CC5=C4)SOO[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=C(C=C3C=C(C=CC3=C2)S(=O)(=O)[O-])SOO[O-])C(=O)NC4=C(C=C5C=C(C=CC5=C4)SOO[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]

InChI

InChI=1S/C28H20N2O14S4.4Na/c31-27(29-23-11-18-6-8-22(47(35,36)37)10-20(18)13-25(23)46-44-42-34)15-1-3-16(4-2-15)28(32)30-24-12-17-5-7-21(45-43-41-33)9-19(17)14-26(24)48(38,39)40;;;;/h1-14,33-34H,(H,29,31)(H,30,32)(H,35,36,37)(H,38,39,40);;;;/q;4*+1/p-4