trisodium 3-azanylidene-4-[2-[4-[2-(2-ethenylsulfonylethoxy)ethylcarbamoylamino]-2-oxidanidylperoxysulfanyl-phenyl]hydrazinyl]-7-oxidanidylperoxysulfanyl-5-oxidanylidene-naphthalene-2-sulfonate

Systemtic Name: trisodium 3-azanylidene-4-[2-[4-[2-(2-ethenylsulfonylethoxy)ethylcarbamoylamino]-2-oxidanidylperoxysulfanyl-phenyl]hydrazinyl]-7-oxidanidylperoxysulfanyl-5-oxidanylidene-naphthalene-2-sulfonate Openeye Name: trisodium 3-imino-7-oxidoperoxysulfanyl-4-[2-[2-oxidoperoxysulfanyl-4-[2-(2-vinylsulfonylethoxy)ethylcarbamoylamino]phenyl]hydrazino]-5-oxo-naphthalene-2-sulfonate CAS Name: trisodium 4-[[4-[[[2-(2-ethenylsulfonylethoxy)ethylamino]-oxomethyl]amino]-2-(oxidodioxythio)phenyl]hydrazo]-3-imino-7-(oxidodioxythio)-5-oxo-2-naphthalenesulfonate IUPAC Name: trisodium 4-[2-[4-[2-(2-ethenylsulfonylethoxy)ethylcarbamoylamino]-2-oxidoperoxysulfanylphenyl]hydrazinyl]-3-imino-7-oxidoperoxysulfanyl-5-oxonaphthalene-2-sulfonate Traditional Name: trisodium 3-imino-5-keto-7-(oxidoperoxythio)-4-[N'-[2-(oxidoperoxythio)-4-[2-(2-vinylsulfonylethoxy)ethylcarbamoylamino]phenyl]hydrazino]naphthalene-2-sulfonate Formula: C23H22N5Na3O14S4 MolecularWeight: 789.67519

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Descriptors Computed from Structure

Canonical SMILES:

C=CS(=O)(=O)CCOCCNC(=O)NC1=CC(=C(C=C1)NNC2=C3C(=CC(=CC3=O)SOO[O-])C=C(C2=N)S(=O)(=O)[O-])SOO[O-].[Na+].[Na+].[Na+]

Isomeric SMILES

C=CS(=O)(=O)CCOCCNC(=O)NC1=CC(=C(C=C1)NNC2=C3C(=CC(=CC3=O)SOO[O-])C=C(C2=N)S(=O)(=O)[O-])SOO[O-].[Na+].[Na+].[Na+]

InChI

InChI=1S/C23H25N5O14S4.3Na/c1-2-45(33,34)8-7-38-6-5-25-23(30)26-14-3-4-16(18(11-14)44-42-40-32)27-28-22-20-13(10-19(21(22)24)46(35,36)37)9-15(12-17(20)29)43-41-39-31;;;/h2-4,9-12,24,27-28,31-32H,1,5-8H2,(H2,25,26,30)(H,35,36,37);;;/q;3*+1/p-3