disodium 7-[[4-[(4-methylphenyl)diazenyl]naphthalen-1-yl]diazenyl]-3-oxidanidylperoxysulfanyl-naphthalene-1-sulfonate

Systemtic Name: disodium 7-[[4-[(4-methylphenyl)diazenyl]naphthalen-1-yl]diazenyl]-3-oxidanidylperoxysulfanyl-naphthalene-1-sulfonate Openeye Name: disodium 3-oxidoperoxysulfanyl-7-[[4-(p-tolylazo)-1-naphthyl]azo]naphthalene-1-sulfonate CAS Name: disodium 7-[[4-(4-methylphenyl)azo-1-naphthalenyl]azo]-3-(oxidodioxythio)-1-naphthalenesulfonate IUPAC Name: disodium 7-[[4-[(4-methylphenyl)diazenyl]naphthalen-1-yl]diazenyl]-3-oxidoperoxysulfanylnaphthalene-1-sulfonate Traditional Name: disodium 3-(oxidoperoxythio)-7-[[4-(p-tolylazo)-1-naphthyl]azo]naphthalene-1-sulfonate Formula: C27H18N4Na2O6S2 MolecularWeight: 604.56456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N=NC2=CC=C(C3=CC=CC=C32)N=NC4=CC5=C(C=C(C=C5C=C4)SOO[O-])S(=O)(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CC1=CC=C(C=C1)N=NC2=CC=C(C3=CC=CC=C32)N=NC4=CC5=C(C=C(C=C5C=C4)SOO[O-])S(=O)(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C27H20N4O6S2.2Na/c1-17-6-9-19(10-7-17)28-30-25-12-13-26(23-5-3-2-4-22(23)25)31-29-20-11-8-18-14-21(38-37-36-32)16-27(24(18)15-20)39(33,34)35;;/h2-16,32H,1H3,(H,33,34,35);;/q;2*+1/p-2