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

Systemtic Name: tetrasodium (6Z)-4-azanyl-3-[[4-(2-oxidanidyloxysulfonylethylsulfonyl)phenyl]diazenyl]-7-oxidanidylperoxysulfanyl-5-oxidanylidene-6-[[4-(2-sulfonatooxyethylsulfonyl)phenyl]hydrazinylidene]naphthalene-2-sulfonate Openeye Name: tetrasodium (6Z)-4-amino-3-[4-(2-oxidooxysulfonylethylsulfonyl)phenyl]azo-7-oxidoperoxysulfanyl-5-oxo-6-[[4-(2-sulfonatooxyethylsulfonyl)phenyl]hydrazono]naphthalene-2-sulfonate CAS Name: tetrasodium (6Z)-4-amino-7-(oxidodioxythio)-3-[4-(2-oxidooxysulfonylethylsulfonyl)phenyl]azo-5-oxo-6-[[4-(2-sulfonatooxyethylsulfonyl)phenyl]hydrazinylidene]-2-naphthalenesulfonate IUPAC Name: tetrasodium (6Z)-4-amino-3-[[4-(2-oxidooxysulfonylethylsulfonyl)phenyl]diazenyl]-7-oxidoperoxysulfanyl-5-oxo-6-[[4-(2-sulfonatooxyethylsulfonyl)phenyl]hydrazinylidene]naphthalene-2-sulfonate Traditional Name: tetrasodium (6Z)-4-amino-5-keto-3-[4-(2-oxidooxysulfonylethylsulfonyl)phenyl]azo-7-(oxidoperoxythio)-6-[[4-(2-sulfatoethylsulfonyl)phenyl]hydrazono]naphthalene-2-sulfonate Formula: C26H21N5Na4O19S6 MolecularWeight: 991.81612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NN=C2C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)S(=O)(=O)CCS(=O)(=O)O[O-])S(=O)(=O)[O-])SOO[O-])S(=O)(=O)CCOS(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC=C1N/N=C/2\C(=CC3=CC(=C(C(=C3C2=O)N)N=NC4=CC=C(C=C4)S(=O)(=O)CCS(=O)(=O)O[O-])S(=O)(=O)[O-])SOO[O-])S(=O)(=O)CCOS(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]

InChI

InChI=1S/C26H25N5O19S6.4Na/c27-23-22-15(14-21(55(41,42)43)25(23)31-29-17-3-7-19(8-4-17)53(37,38)11-12-54(39,40)49-34)13-20(51-50-48-33)24(26(22)32)30-28-16-1-5-18(6-2-16)52(35,36)10-9-47-56(44,45)46;;;;/h1-8,13-14,28,33-34H,9-12,27H2,(H,41,42,43)(H,44,45,46);;;;/q;4*+1/p-4/b30-24+,31-29?;;;;