tetrasodium (6Z)-4-azanyl-6-[[2-methoxy-5-(2-oxidanidylperoxysulfanyloxyethylperoxysulfanyl)phenyl]hydrazinylidene]-7-oxidanidylperoxysulfanyl-5-oxidanylidene-3-[[4-(2-sulfonatooxyethoxysulfinyl)phenyl]diazenyl]naphthalene-2-sulfonate

Systemtic Name: tetrasodium (6Z)-4-azanyl-6-[[2-methoxy-5-(2-oxidanidylperoxysulfanyloxyethylperoxysulfanyl)phenyl]hydrazinylidene]-7-oxidanidylperoxysulfanyl-5-oxidanylidene-3-[[4-(2-sulfonatooxyethoxysulfinyl)phenyl]diazenyl]naphthalene-2-sulfonate Openeye Name: tetrasodium (6Z)-4-amino-6-[[2-methoxy-5-(2-oxidoperoxysulfanyloxyethylperoxysulfanyl)phenyl]hydrazono]-7-oxidoperoxysulfanyl-5-oxo-3-[4-(2-sulfonatooxyethoxysulfinyl)phenyl]azo-naphthalene-2-sulfonate CAS Name: tetrasodium (6Z)-4-amino-6-[[2-methoxy-5-[2-(oxidodioxythio)oxyethyldioxythio]phenyl]hydrazinylidene]-7-(oxidodioxythio)-5-oxo-3-[4-(2-sulfonatooxyethoxysulfinyl)phenyl]azo-2-naphthalenesulfonate IUPAC Name: tetrasodium (6Z)-4-amino-6-[[2-methoxy-5-(2-oxidoperoxysulfanyloxyethylperoxysulfanyl)phenyl]hydrazinylidene]-7-oxidoperoxysulfanyl-5-oxo-3-[[4-(2-sulfonatooxyethoxysulfinyl)phenyl]diazenyl]naphthalene-2-sulfonate Traditional Name: tetrasodium (6Z)-4-amino-5-keto-6-[[2-methoxy-5-[2-(oxidoperoxythio)oxyethylperoxythio]phenyl]hydrazono]-7-(oxidoperoxythio)-3-[4-(2-sulfatoethoxysulfinyl)phenyl]azo-naphthalene-2-sulfonate Formula: C27H23N5Na4O20S6 MolecularWeight: 1021.8421

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)SOOCCOSOO[O-])NN=C2C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)S(=O)OCCOS(=O)(=O)[O-])S(=O)(=O)[O-])SOO[O-].[Na+].[Na+].[Na+].[Na+]

Isomeric SMILES

COC1=C(C=C(C=C1)SOOCCOSOO[O-])N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)S(=O)OCCOS(=O)(=O)[O-])S(=O)(=O)[O-])SOO[O-].[Na+].[Na+].[Na+].[Na+]

InChI

InChI=1S/C27H27N5O20S6.4Na/c1-43-20-7-4-17(53-50-44-8-9-45-55-52-49-35)14-19(20)30-31-25-21(54-51-48-34)12-15-13-22(57(37,38)39)26(24(28)23(15)27(25)33)32-29-16-2-5-18(6-3-16)56(36)46-10-11-47-58(40,41)42;;;;/h2-7,12-14,30,34-35H,8-11,28H2,1H3,(H,37,38,39)(H,40,41,42);;;;/q;4*+1/p-4/b31-25+,32-29?;;;;