tetrapotassium 2-[5-methyl-4-[(Z)-[3-methyl-1-(5-oxidanidylperoxysulfanyl-2-sulfonato-phenyl)-5-oxidanylidene-pyrazol-4-ylidene]methyl]-3-oxidanylidene-1H-pyrazol-2-yl]-4-oxidanidylperoxysulfanyl-benzenesulfonate

Systemtic Name: tetrapotassium 2-[5-methyl-4-[(Z)-[3-methyl-1-(5-oxidanidylperoxysulfanyl-2-sulfonato-phenyl)-5-oxidanylidene-pyrazol-4-ylidene]methyl]-3-oxidanylidene-1H-pyrazol-2-yl]-4-oxidanidylperoxysulfanyl-benzenesulfonate Openeye Name: tetrapotassium 2-[5-methyl-4-[(Z)-[3-methyl-1-(5-oxidoperoxysulfanyl-2-sulfonato-phenyl)-5-oxo-pyrazol-4-ylidene]methyl]-3-oxo-1H-pyrazol-2-yl]-4-oxidoperoxysulfanyl-benzenesulfonate CAS Name: tetrapotassium 2-[5-methyl-4-[(Z)-[3-methyl-1-[5-(oxidodioxythio)-2-sulfonatophenyl]-5-oxo-4-pyrazolylidene]methyl]-3-oxo-1H-pyrazol-2-yl]-4-(oxidodioxythio)benzenesulfonate IUPAC Name: tetrapotassium 2-[5-methyl-4-[(Z)-[3-methyl-1-(5-oxidoperoxysulfanyl-2-sulfonatophenyl)-5-oxopyrazol-4-ylidene]methyl]-3-oxo-1H-pyrazol-2-yl]-4-oxidoperoxysulfanylbenzenesulfonate Traditional Name: tetrapotassium 2-[5-keto-4-[(Z)-[5-keto-3-methyl-1-[5-(oxidoperoxythio)-2-sulfonato-phenyl]-2-pyrazolin-4-ylidene]methyl]-3-methyl-3-pyrazolin-1-yl]-4-(oxidoperoxythio)besylate Formula: C21H14K4N4O14S4 MolecularWeight: 831.00746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1)C2=C(C=CC(=C2)SOO[O-])S(=O)(=O)[O-])C=C3C(=NN(C3=O)C4=C(C=CC(=C4)SOO[O-])S(=O)(=O)[O-])C.[K+].[K+].[K+].[K+]

Isomeric SMILES

CC1=C(C(=O)N(N1)C2=C(C=CC(=C2)SOO[O-])S(=O)(=O)[O-])/C=C\3/C(=NN(C3=O)C4=C(C=CC(=C4)SOO[O-])S(=O)(=O)[O-])C.[K+].[K+].[K+].[K+]

InChI

InChI=1S/C21H18N4O14S4.4K/c1-10-14(20(26)24(22-10)16-7-12(40-38-36-28)3-5-18(16)42(30,31)32)9-15-11(2)23-25(21(15)27)17-8-13(41-39-37-29)4-6-19(17)43(33,34)35;;;;/h3-9,22,28-29H,1-2H3,(H,30,31,32)(H,33,34,35);;;;/q;4*+1/p-4/b15-9-;;;;