trisodium 5-[2-(6-oxidanidylperoxysulfanyl-8-sulfonato-naphthalen-2-yl)hydrazinyl]-6,7-bis(oxidanylidene)-8-[(2Z)-2-(4-oxidanylidenenaphthalen-1-ylidene)hydrazinyl]naphthalene-2-sulfonate

Systemtic Name: trisodium 5-[2-(6-oxidanidylperoxysulfanyl-8-sulfonato-naphthalen-2-yl)hydrazinyl]-6,7-bis(oxidanylidene)-8-[(2Z)-2-(4-oxidanylidenenaphthalen-1-ylidene)hydrazinyl]naphthalene-2-sulfonate Openeye Name: trisodium 5-[2-(6-oxidoperoxysulfanyl-8-sulfonato-2-naphthyl)hydrazino]-6,7-dioxo-8-[(2Z)-2-(4-oxo-1-naphthylidene)hydrazino]naphthalene-2-sulfonate CAS Name: trisodium 5-[[6-(oxidodioxythio)-8-sulfonato-2-naphthalenyl]hydrazo]-6,7-dioxo-8-[(2Z)-2-(4-oxo-1-naphthalenylidene)hydrazinyl]-2-naphthalenesulfonate IUPAC Name: trisodium 5-[2-(6-oxidoperoxysulfanyl-8-sulfonatonaphthalen-2-yl)hydrazinyl]-6,7-dioxo-8-[(2Z)-2-(4-oxonaphthalen-1-ylidene)hydrazinyl]naphthalene-2-sulfonate Traditional Name: trisodium 6,7-diketo-8-[(N'Z)-N'-(4-keto-1-naphthylidene)hydrazino]-5-[N'-[6-(oxidoperoxythio)-8-sulfonato-2-naphthyl]hydrazino]naphthalene-2-sulfonate Formula: C30H17N4Na3O12S3 MolecularWeight: 790.63989

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=O)C=CC(=NNC3=C4C=C(C=CC4=C(C(=O)C3=O)NNC5=CC6=C(C=C(C=C6C=C5)SOO[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])C2=C1.[Na+].[Na+].[Na+]

Isomeric SMILES

C1=CC=C2C(=O)C=C/C(=N/NC3=C4C=C(C=CC4=C(C(=O)C3=O)NNC5=CC6=C(C=C(C=C6C=C5)SOO[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])/C2=C1.[Na+].[Na+].[Na+]

InChI

InChI=1S/C30H20N4O12S3.3Na/c35-25-10-9-24(19-3-1-2-4-20(19)25)32-34-28-23-14-18(48(39,40)41)7-8-21(23)27(29(36)30(28)37)33-31-16-6-5-15-11-17(47-46-45-38)13-26(22(15)12-16)49(42,43)44;;;/h1-14,31,33-34,38H,(H,39,40,41)(H,42,43,44);;;/q;3*+1/p-3/b32-24-;;;