Tetrasodium 3,3'-(carbonyldiimino)bis[6-({1-[(2-methoxy-5-sulfonatophenyl)amino]-1,3-dioxo-2-butanyl}diazenyl)benzoate]
[CAS 72749-83-8]

Identification

• Name: Tetrasodium 3,3'-(carbonyldiimino)bis[6-({1-[(2-methoxy-5-sulfonatophenyl)amino]-1,3-dioxo-2-butanyl}diazenyl)benzoate]
• Synonyms: Benzoic acid, 3,3'-(carbonyldiimino)bis[6-[[1-[[(2-methoxy-5-sulfophenyl)amino]carbonyl]-2-oxopropyl]azo]-, tetrasodium salt
• Molecular Formula: C₃₇H₃₀N₈Na₄O₁₇S₂
• Molecular Weight: 1014.77
• CAS Registry Number: 72749-83-8
• SMILES: CC(=O)C(C(=O)Nc1cc(ccc1OC)S(=O)(=O)[O-])N=Nc2ccc(cc2C(=O)[O-])NC(=O)Nc3ccc(c(c3)C(=O)[O-])N=NC(C(=O)C)C(=O)Nc4cc(ccc4OC)S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+]
• InChI: 1S/C37H34N8O17S2.4Na/c1-17(46)31(33(48)40-27-15-21(63(55,56)57)7-11-29(27)61-3)44-42-25-9-5-19(13-23(25)35(50)51)38-37(54)39-20-6-10-26(24(14-20)36(52)53)43-45-32(18(2)47)34(49)41-28-16-22(64(58,59)60)8-12-30(28)62-4;;;;/h5-16,31-32H,1-4H3,(H,40,48)(H,41,49)(H,50,51)(H,52,53)(H2,38,39,54)(H,55,56,57)(H,58,59,60);;;;/q;4*+1/p-4
• InChIKey: AYXVBBHZXZIFOO-UHFFFAOYSA-J