4,4'-(carbonylbis(imino(1-hydroxy-3-sulfo-6,2-naphthalenediyl)azo)bis-Benzoic acid compd. with 2,2',2''-nitrilotris(ethanol) (1:4)
[CAS# 38801-08-0]

Identification

• Name: 4,4'-(carbonylbis(imino(1-hydroxy-3-sulfo-6,2-naphthalenediyl)azo)bis-Benzoic acid compd. with 2,2',2''-nitrilotris(ethanol) (1:4)
• Synonyms: 2-(Bis(2-Hydroxyethyl)Amino)Ethanol; 4-[(N'e)-N'-[6-[[(6Z)-6-[(4-Carboxyphenyl)Hydrazono]-5-Oxo-7-Sulfo-2-Naphthyl]Carbamoylamino]-1-Oxo-3-Sulfo-2-Naphthylidene]Hydrazino]Benzoic Acid; 2-(Bis(2-Hydroxyethyl)Amino)Ethanol; 4-[(N'e)-N'-[6-[[[[(6Z)-6-[(4-Carboxyphenyl)Hydrazono]-5-Oxo-7-Sulfo-2-Naphthyl]Amino]-Oxomethyl]Amino]-1-Oxo-3-Sulfo-2-Naphthylidene]Hydrazino]Benzoic Acid; 2-(Bis(2-Hydroxyethyl)Amino)Ethanol; 4-[(N'e)-N'-[6-[[(6Z)-6-[(4-Carboxyphenyl)Hydrazono]-5-Keto-7-Sulfo-2-Naphthyl]Carbamoylamino]-1-Keto-3-Sulfo-2-Naphthylidene]Hydrazino]Benzoic Acid
• Molecular Formula: C₅₉H₈₄N₁₀O₂₅S₂
• Molecular Weight: 1397.48
• CAS Registry Number: 38801-08-0
• SMILES: C4=C(NC(=O)NC3=CC2=C(C(=O)C(=N/NC1=CC=C(C=C1)C(O)=O)/C(=C2)[S](O)(=O)=O)C=C3)C=CC6=C4C=C([S](O)(=O)=O)/C(=N/NC5=CC=C(C=C5)C(O)=O)C6=O.C(N(CCO)CCO)CO.C(N(CCO)CCO)CO.C(N(CCO)CCO)CO.C(N(CCO)CCO)CO
• InChI: 1S/C35H24N6O13S2.4C6H15NO3/c42-31-25-11-9-23(13-19(25)15-27(55(49,50)51)29(31)40-38-21-5-1-17(2-6-21)33(44)45)36-35(48)37-24-10-12-26-20(14-24)16-28(56(52,53)54)30(32(26)43)41-39-22-7-3-18(4-8-22)34(46)47;4*8-4-1-7(2-5-9)3-6-10/h1-16,38-39H,(H,44,45)(H,46,47)(H2,36,37,48)(H,49,50,51)(H,52,53,54);4*8-10H,1-6H2/b40-29-,41-30+
• InChIKey: IVDNHKALZDDUQP-JWHRJHEESA-N