Disodium 1-Amino-4-[3-[[(3,6-Dichloropyridazin-4-Yl)Carbonyl]Amino]-2,4,6-Trimethyl-5-Sulphonatoanilino]-9,10-Dihydro-9,10-Dioxoanthracene-2-Sulphonate
[CAS# 94021-06-4]

Identification

• Name: Disodium 1-Amino-4-[3-[[(3,6-Dichloropyridazin-4-Yl)Carbonyl]Amino]-2,4,6-Trimethyl-5-Sulphonatoanilino]-9,10-Dihydro-9,10-Dioxoanthracene-2-Sulphonate
• Synonyms: Disodium 1-Amino-4-[[3-[(3,6-Dichloropyridazine-4-Carbonyl)Amino]-2,4,6-Trimethyl-5-Sulfonato-Phenyl]Amino]-9,10-Dioxo-Anthracene-2-Sulfonate; Disodium 1-Amino-4-[[3-[[(3,6-Dichloro-4-Pyridazinyl)-Oxomethyl]Amino]-2,4,6-Trimethyl-5-Sulfonatophenyl]Amino]-9
• Molecular Formula: C₂₈H₁₉Cl₂N₅Na₂O₉S₂
• Molecular Weight: 750.49
• CAS Registry Number: 94021-06-4
• EINECS: 301-399-7
• SMILES: C1=C([S]([O-])(=O)=O)C(=C4C(=C1NC2=C(C(=C(C(=C2C)NC(=O)C3=CC(=NN=C3Cl)Cl)C)[S]([O-])(=O)=O)C)C(=O)C5=C(C4=O)C=CC=C5)N.[Na+].[Na+]
• InChI: 1S/C28H21Cl2N5O9S2.2Na/c1-10-22(11(2)26(46(42,43)44)12(3)23(10)33-28(38)15-8-18(29)34-35-27(15)30)32-16-9-17(45(39,40)41)21(31)20-19(16)24(36)13-6-4-5-7-14(13)25(20)37;;/h4-9,32H,31H2,1-3H3,(H,33,38)(H,39,40,41)(H,42,43,44);;/q;2*+1/p-2
• InChIKey: GFJJJEAJJKHNRO-UHFFFAOYSA-L