Sodium 3-Benzamido-4-Hydroxy-5-[[1-[[4'-[[2-[[2-Hydroxy-5-(Methylsulphonyl)Phenyl]Azo]-1,3-Dioxobutyl]Amino]-3,3'-Dimethoxy[1,1'-Biphenyl]-4-Yl]Carbamoyl]-2-Oxopropyl]Azo]Benzenesulphonate
[CAS# 70210-32-1]

Identification

• Name: Sodium 3-Benzamido-4-Hydroxy-5-[[1-[[4'-[[2-[[2-Hydroxy-5-(Methylsulphonyl)Phenyl]Azo]-1,3-Dioxobutyl]Amino]-3,3'-Dimethoxy[1,1'-Biphenyl]-4-Yl]Carbamoyl]-2-Oxopropyl]Azo]Benzenesulphonate
• Synonyms: Sodium 3-(Benzoylimino)-5-[N'-[1-[[2-Methoxy-4-[3-Methoxy-4-[[2-[(N'e)-N'-(3-Methylsulfonyl-6-Oxo-1-Cyclohexa-2,4-Dienylidene)Hydrazino]-3-Oxo-Butanoyl]Amino]Phenyl]Phenyl]Carbamoyl]-2-Oxo-Propyl]Hydrazino]-4-Oxo-Cyclohexa-1,5-Diene-1-Sulfonate; Sodium 5-[N'-[1-[[[2-Methoxy-4-[3-Methoxy-4-[[2-[(N'e)-N'-(3-Methylsulfonyl-6-Oxo-1-Cyclohexa-2,4-Dienylidene)Hydrazino]-1,3-Dioxobutyl]Amino]Phenyl]Phenyl]Amino]-Oxomethyl]-2-Oxopropyl]Hydrazino]-4-Oxo-3-(Oxo-Phenylmethyl)Imino-1-Cyclohexa-1,5-Dienesulfonate; Sodium 3-(Benzoylimino)-4-Keto-5-[N'-[2-Keto-1-[[4-[4-[[3-Keto-2-[(N'e)-N'-(6-Keto-3-Mesyl-1-Cyclohexa-2,4-Dienylidene)Hydrazino]Butanoyl]Amino]-3-Methoxy-Phenyl]-2-Methoxy-Phenyl]Carbamoyl]Propyl]Hydrazino]Cyclohexa-1,5-Diene-1-Sulfonate
• Molecular Formula: C₄₂H₃₈N₇NaO₁₄S₂
• Molecular Weight: 951.91
• CAS Registry Number: 70210-32-1
• EINECS: 274-428-3
• SMILES: C3=C(C2=CC(=C(NC(=O)C(N\N=C\1C=C([S](=O)(=O)C)C=CC1=O)C(=O)C)C=C2)OC)C=CC(=C3OC)NC(=O)C(NNC5=CC(=CC(=NC(=O)C4=CC=CC=C4)C5=O)[S]([O-])(=O)=O)C(=O)C.[Na+]
• InChI: 1S/C42H39N7O14S2.Na/c1-22(50)37(48-46-31-19-27(64(5,57)58)13-16-34(31)52)41(55)43-29-14-11-25(17-35(29)62-3)26-12-15-30(36(18-26)63-4)44-42(56)38(23(2)51)49-47-33-21-28(65(59,60)61)20-32(39(33)53)45-40(54)24-9-7-6-8-10-24;/h6-21,37-38,47-49H,1-5H3,(H,43,55)(H,44,56)(H,59,60,61);/q;+1/p-1/b45-32?,46-31+
• InChIKey: XOQXLNJSTZBMQE-MFFSSWIOSA-M