trisodium (6E)-4-benzamido-7-oxidanidylperoxysulfanyl-5-oxidanylidene-6-[(1-sulfonatonaphthalen-2-yl)hydrazinylidene]naphthalene-2-sulfonate

Systemtic Name: trisodium (6E)-4-benzamido-7-oxidanidylperoxysulfanyl-5-oxidanylidene-6-[(1-sulfonatonaphthalen-2-yl)hydrazinylidene]naphthalene-2-sulfonate Openeye Name: trisodium (6E)-4-benzamido-7-oxidoperoxysulfanyl-5-oxo-6-[(1-sulfonato-2-naphthyl)hydrazono]naphthalene-2-sulfonate CAS Name: trisodium (6E)-4-benzamido-7-(oxidodioxythio)-5-oxo-6-[(1-sulfonato-2-naphthalenyl)hydrazinylidene]-2-naphthalenesulfonate IUPAC Name: trisodium (6E)-4-benzamido-7-oxidoperoxysulfanyl-5-oxo-6-[(1-sulfonatonaphthalen-2-yl)hydrazinylidene]naphthalene-2-sulfonate Traditional Name: trisodium (6E)-4-benzamido-5-keto-7-(oxidoperoxythio)-6-[(1-sulfonato-2-naphthyl)hydrazono]naphthalene-2-sulfonate Formula: C27H16N3Na3O11S3 MolecularWeight: 723.59375

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(C(=NNC4=C(C5=CC=CC=C5C=C4)S(=O)(=O)[O-])C3=O)SOO[O-].[Na+].[Na+].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=C3C(=CC(=C2)S(=O)(=O)[O-])C=C(/C(=N/NC4=C(C5=CC=CC=C5C=C4)S(=O)(=O)[O-])/C3=O)SOO[O-].[Na+].[Na+].[Na+]

InChI

InChI=1S/C27H19N3O11S3.3Na/c31-25-23-17(12-18(43(34,35)36)14-21(23)28-27(32)16-7-2-1-3-8-16)13-22(42-41-40-33)24(25)30-29-20-11-10-15-6-4-5-9-19(15)26(20)44(37,38)39;;;/h1-14,29,33H,(H,28,32)(H,34,35,36)(H,37,38,39);;;/q;3*+1/p-3/b30-24-;;;