tetrasodium 7-oxidanidylperoxysulfanyl-5-[[6-[(6-oxidanidylperoxysulfanyl-8-oxidanyl-3-sulfonato-naphthalen-1-yl)sulfamoyl]naphthalen-2-yl]sulfonylamino]-4-oxidanyl-naphthalene-2-sulfonate

Systemtic Name: tetrasodium 7-oxidanidylperoxysulfanyl-5-[[6-[(6-oxidanidylperoxysulfanyl-8-oxidanyl-3-sulfonato-naphthalen-1-yl)sulfamoyl]naphthalen-2-yl]sulfonylamino]-4-oxidanyl-naphthalene-2-sulfonate Openeye Name: tetrasodium 4-hydroxy-5-[[6-[(8-hydroxy-6-oxidoperoxysulfanyl-3-sulfonato-1-naphthyl)sulfamoyl]-2-naphthyl]sulfonylamino]-7-oxidoperoxysulfanyl-naphthalene-2-sulfonate CAS Name: tetrasodium 4-hydroxy-5-[[6-[[8-hydroxy-6-(oxidodioxythio)-3-sulfonato-1-naphthalenyl]sulfamoyl]-2-naphthalenyl]sulfonylamino]-7-(oxidodioxythio)-2-naphthalenesulfonate IUPAC Name: tetrasodium 4-hydroxy-5-[[6-[(8-hydroxy-6-oxidoperoxysulfanyl-3-sulfonatonaphthalen-1-yl)sulfamoyl]naphthalen-2-yl]sulfonylamino]-7-oxidoperoxysulfanylnaphthalene-2-sulfonate Traditional Name: tetrasodium 4-hydroxy-5-[[6-[[8-hydroxy-6-(oxidoperoxythio)-3-sulfonato-1-naphthyl]sulfamoyl]-2-naphthyl]sulfonylamino]-7-(oxidoperoxythio)naphthalene-2-sulfonate Formula: C30H18N2Na4O18S6 MolecularWeight: 978.8156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)S(=O)(=O)NC3=C4C(=CC(=C3)SOO[O-])C=C(C=C4O)S(=O)(=O)[O-])C=C1S(=O)(=O)NC5=CC(=CC6=CC(=CC(=C65)O)SOO[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]

Isomeric SMILES

C1=CC2=C(C=CC(=C2)S(=O)(=O)NC3=C4C(=CC(=C3)SOO[O-])C=C(C=C4O)S(=O)(=O)[O-])C=C1S(=O)(=O)NC5=CC(=CC6=CC(=CC(=C65)O)SOO[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]

InChI

InChI=1S/C30H22N2O18S6.4Na/c33-27-12-20(52-50-48-36)6-18-9-23(55(41,42)43)13-26(30(18)27)32-54(39,40)22-4-2-15-7-21(3-1-16(15)8-22)53(37,38)31-25-11-19(51-49-47-35)5-17-10-24(56(44,45)46)14-28(34)29(17)25;;;;/h1-14,31-36H,(H,41,42,43)(H,44,45,46);;;;/q;4*+1/p-4