Disodium 4,6-Dihydroxy-3-[[4-[1-[4-[[1-Hydroxy-7-[(Phenylsulphonyl)Oxy]-3-Sulphonato-2-Naphthyl]Azo]Phenyl]Cyclohexyl]Phenyl]Azo]Naphthalene-2-Sulphonate
[CAS# 13421-53-9]

Identification

• Name: Disodium 4,6-Dihydroxy-3-[[4-[1-[4-[[1-Hydroxy-7-[(Phenylsulphonyl)Oxy]-3-Sulphonato-2-Naphthyl]Azo]Phenyl]Cyclohexyl]Phenyl]Azo]Naphthalene-2-Sulphonate
• Synonyms: Disodium 4,6-Dioxo-3-[N'-[4-[1-[4-[(N'e)-N'-(1-Oxo-7-Phenylsulfonyloxy-3-Sulfonato-2-Naphthylidene)Hydrazino]Phenyl]Cyclohexyl]Phenyl]Hydrazino]Naphthalene-2-Sulfonate; Disodium 4,6-Dioxo-3-[N'-[4-[1-[4-[(N'e)-N'-(1-Oxo-7-Phenylsulfonyloxy-3-Sulfonato-2-Naphthylidene)Hydrazino]Phenyl]Cyclohexyl]Phenyl]Hydrazino]-2-Naphthalenesulfonate; Disodium 4,6-Diketo-3-[N'-[4-[1-[4-[(N'e)-N'-(1-Keto-7-Phenylsulfonyloxy-3-Sulfonato-2-Naphthylidene)Hydrazino]Phenyl]Cyclohexyl]Phenyl]Hydrazino]Naphthalene-2-Sulfonate
• Molecular Formula: C₄₄H₃₄N₄Na₂O₁₂S₃
• Molecular Weight: 952.93
• CAS Registry Number: 13421-53-9
• EINECS: 236-531-1
• SMILES: C6=C(C1(CCCCC1)C5=CC=C(N\N=C2\C(=CC4=C(C2=O)C=C(O[S](=O)(=O)C3=CC=CC=C3)C=C4)[S]([O-])(=O)=O)C=C5)C=CC(=C6)NNC8=C([S]([O-])(=O)=O)C=C7C(=CC(=O)C=C7)C8=O.[Na+].[Na+]
• InChI: 1S/C44H36N4O12S3.2Na/c49-33-19-9-27-23-38(61(52,53)54)40(42(50)36(27)25-33)47-45-31-15-11-29(12-16-31)44(21-5-2-6-22-44)30-13-17-32(18-14-30)46-48-41-39(62(55,56)57)24-28-10-20-34(26-37(28)43(41)51)60-63(58,59)35-7-3-1-4-8-35;;/h1,3-4,7-20,23-26,45-47H,2,5-6,21-22H2,(H,52,53,54)(H,55,56,57);;/q;2*+1/p-2/b48-41-
• InChIKey: ICJJDVBQIHZVGO-FDVDQXEGSA-L