tetrasodium (3E)-5-acetamido-8-oxidanidylperoxysulfanyl-3-[[7-oxidanidylperoxysulfanyl-4-[(4-sulfonatophenyl)diazenyl]naphthalen-1-yl]hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonate

Systemtic Name: tetrasodium (3E)-5-acetamido-8-oxidanidylperoxysulfanyl-3-[[7-oxidanidylperoxysulfanyl-4-[(4-sulfonatophenyl)diazenyl]naphthalen-1-yl]hydrazinylidene]-4-oxidanylidene-naphthalene-2-sulfonate Openeye Name: tetrasodium (3E)-5-acetamido-8-oxidoperoxysulfanyl-3-[[7-oxidoperoxysulfanyl-4-(4-sulfonatophenyl)azo-1-naphthyl]hydrazono]-4-oxo-naphthalene-2-sulfonate CAS Name: tetrasodium (3E)-5-acetamido-8-(oxidodioxythio)-3-[[7-(oxidodioxythio)-4-(4-sulfonatophenyl)azo-1-naphthalenyl]hydrazinylidene]-4-oxo-2-naphthalenesulfonate IUPAC Name: tetrasodium (3E)-5-acetamido-8-oxidoperoxysulfanyl-3-[[7-oxidoperoxysulfanyl-4-[(4-sulfonatophenyl)diazenyl]naphthalen-1-yl]hydrazinylidene]-4-oxonaphthalene-2-sulfonate Traditional Name: tetrasodium (3E)-5-acetamido-4-keto-8-(oxidoperoxythio)-3-[[7-(oxidoperoxythio)-4-(4-sulfonatophenyl)azo-1-naphthyl]hydrazono]naphthalene-2-sulfonate Formula: C28H17N5Na4O14S4 MolecularWeight: 867.67876

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C2C(=C(C=C1)SOO[O-])C=C(C(=NNC3=C4C=C(C=CC4=C(C=C3)N=NC5=CC=C(C=C5)S(=O)(=O)[O-])SOO[O-])C2=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]

Isomeric SMILES

CC(=O)NC1=C2C(=C(C=C1)SOO[O-])C=C(/C(=N/NC3=C4C=C(C=CC4=C(C=C3)N=NC5=CC=C(C=C5)S(=O)(=O)[O-])SOO[O-])/C2=O)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]

InChI

InChI=1S/C28H21N5O14S4.4Na/c1-14(34)29-23-10-11-24(49-47-45-37)20-13-25(51(41,42)43)27(28(35)26(20)23)33-32-22-9-8-21(18-7-4-16(12-19(18)22)48-46-44-36)31-30-15-2-5-17(6-3-15)50(38,39)40;;;;/h2-13,32,36-37H,1H3,(H,29,34)(H,38,39,40)(H,41,42,43);;;;/q;4*+1/p-4/b31-30?,33-27-;;;;