sodium [(3E)-3-[[4-[(4-oxidanidylperoxysulfanylphenyl)diazenyl]phenyl]hydrazinylidene]-4-oxidanylidene-7-phenylazanyl-naphthalen-2-yl] methanesulfonate

Systemtic Name: sodium [(3E)-3-[[4-[(4-oxidanidylperoxysulfanylphenyl)diazenyl]phenyl]hydrazinylidene]-4-oxidanylidene-7-phenylazanyl-naphthalen-2-yl] methanesulfonate Openeye Name: sodium [(3E)-7-anilino-3-[[4-(4-oxidoperoxysulfanylphenyl)azophenyl]hydrazono]-4-oxo-2-naphthyl] methanesulfonate CAS Name: sodium methanesulfonic acid [(3E)-7-anilino-3-[[4-[4-(oxidodioxythio)phenyl]azophenyl]hydrazinylidene]-4-oxo-2-naphthalenyl] ester IUPAC Name: sodium [(3E)-7-anilino-3-[[4-[(4-oxidoperoxysulfanylphenyl)diazenyl]phenyl]hydrazinylidene]-4-oxonaphthalen-2-yl] methanesulfonate Traditional Name: sodium methanesulfonic acid [(3E)-7-anilino-4-keto-3-[[4-[4-(oxidoperoxythio)phenyl]azophenyl]hydrazono]-2-naphthyl] ester Formula: C29H22N5NaO7S2 MolecularWeight: 639.63405

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC2=C(C=CC(=C2)NC3=CC=CC=C3)C(=O)C1=NNC4=CC=C(C=C4)N=NC5=CC=C(C=C5)SOO[O-].[Na+]

Isomeric SMILES

CS(=O)(=O)OC\1=CC2=C(C=CC(=C2)NC3=CC=CC=C3)C(=O)/C1=N/NC4=CC=C(C=C4)N=NC5=CC=C(C=C5)SOO[O-].[Na+]

InChI

InChI=1S/C29H23N5O7S2.Na/c1-43(37,38)39-27-18-19-17-24(30-20-5-3-2-4-6-20)13-16-26(19)29(35)28(27)34-33-22-9-7-21(8-10-22)31-32-23-11-14-25(15-12-23)42-41-40-36;/h2-18,30,33,36H,1H3;/q;+1/p-1/b32-31?,34-28+;