tetrasodium (6Z)-4-[[4-chloranyl-6-[(5-sulfonatonaphthalen-1-yl)amino]-1,3,5-triazin-2-yl]amino]-7-oxidanidylperoxysulfanyl-5-oxidanylidene-6-[(2-sulfonatophenyl)hydrazinylidene]naphthalene-2-sulfonate

Systemtic Name: tetrasodium (6Z)-4-[[4-chloranyl-6-[(5-sulfonatonaphthalen-1-yl)amino]-1,3,5-triazin-2-yl]amino]-7-oxidanidylperoxysulfanyl-5-oxidanylidene-6-[(2-sulfonatophenyl)hydrazinylidene]naphthalene-2-sulfonate Openeye Name: tetrasodium (6Z)-4-[[4-chloro-6-[(5-sulfonato-1-naphthyl)amino]-1,3,5-triazin-2-yl]amino]-7-oxidoperoxysulfanyl-5-oxo-6-[(2-sulfonatophenyl)hydrazono]naphthalene-2-sulfonate CAS Name: tetrasodium (6Z)-4-[[4-chloro-6-[(5-sulfonato-1-naphthalenyl)amino]-1,3,5-triazin-2-yl]amino]-7-(oxidodioxythio)-5-oxo-6-[(2-sulfonatophenyl)hydrazinylidene]-2-naphthalenesulfonate IUPAC Name: tetrasodium (6Z)-4-[[4-chloro-6-[(5-sulfonatonaphthalen-1-yl)amino]-1,3,5-triazin-2-yl]amino]-7-oxidoperoxysulfanyl-5-oxo-6-[(2-sulfonatophenyl)hydrazinylidene]naphthalene-2-sulfonate Traditional Name: tetrasodium (6Z)-4-[[4-chloro-6-[(5-sulfonato-1-naphthyl)amino]-s-triazin-2-yl]amino]-5-keto-7-(oxidoperoxythio)-6-[(2-sulfonatophenyl)hydrazono]naphthalene-2-sulfonate Formula: C29H16ClN7Na4O13S4 MolecularWeight: 926.14852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NN=C2C(=CC3=CC(=CC(=C3C2=O)NC4=NC(=NC(=N4)NC5=CC=CC6=C5C=CC=C6S(=O)(=O)[O-])Cl)S(=O)(=O)[O-])SOO[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]

Isomeric SMILES

C1=CC=C(C(=C1)N/N=C/2\C(=CC3=CC(=CC(=C3C2=O)NC4=NC(=NC(=N4)NC5=CC=CC6=C5C=CC=C6S(=O)(=O)[O-])Cl)S(=O)(=O)[O-])SOO[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]

InChI

InChI=1S/C29H20ClN7O13S4.4Na/c30-27-33-28(31-18-8-3-6-17-16(18)5-4-10-22(17)53(43,44)45)35-29(34-27)32-20-13-15(52(40,41)42)11-14-12-21(51-50-49-39)25(26(38)24(14)20)37-36-19-7-1-2-9-23(19)54(46,47)48;;;;/h1-13,36,39H,(H,40,41,42)(H,43,44,45)(H,46,47,48)(H2,31,32,33,34,35);;;;/q;4*+1/p-4/b37-25+;;;;