Pentasodium 7-[[3-(Acetylamino)-4-[[4-[[5-[(4-Amino-9,10-Dihydro-9,10-Dioxo-3-Sulphonato-1-Anthryl)Amino]-2-Sulphonatophenyl]Amino]-6-Chloro-1,3,5-Triazin-2-Yl]Amino]Phenyl]Azo]Naphthalene-1,3,6-Trisulphonate
[CAS# 73398-35-3]

Identification

• Name: Pentasodium 7-[[3-(Acetylamino)-4-[[4-[[5-[(4-Amino-9,10-Dihydro-9,10-Dioxo-3-Sulphonato-1-Anthryl)Amino]-2-Sulphonatophenyl]Amino]-6-Chloro-1,3,5-Triazin-2-Yl]Amino]Phenyl]Azo]Naphthalene-1,3,6-Trisulphonate
• Synonyms: Pentasodium 7-[3-Acetamido-4-[[4-[[5-[(4-Amino-9,10-Dioxo-3-Sulfonato-1-Anthryl)Amino]-2-Sulfonato-Phenyl]Amino]-6-Chloro-1,3,5-Triazin-2-Yl]Amino]Phenyl]Azonaphthalene-1,3,6-Trisulfonate; Pentasodium 7-[3-Acetamido-4-[[4-[[5-[(4-Amino-9,10-Dioxo-3-Sulfonato-1-Anthryl)Amino]-2-Sulfonatophenyl]Amino]-6-Chloro-1,3,5-Triazin-2-Yl]Amino]Phenyl]Azonaphthalene-1,3,6-Trisulfonate; Pentasodium 7-[3-Acetamido-4-[[4-[[5-[(4-Amino-9,10-Diketo-3-Sulfonato-1-Anthryl)Amino]-2-Sulfonato-Phenyl]Amino]-6-Chloro-S-Triazin-2-Yl]Amino]Phenyl]Azonaphthalene-1,3,6-Trisulfonate
• Molecular Formula: C₄₁H₂₄ClN₁₀Na₅O₁₈S₅
• Molecular Weight: 1255.40
• CAS Registry Number: 73398-35-3
• EINECS: 277-433-9
• SMILES: C8=C(NC1=CC(=C([S]([O-])(=O)=O)C=C1)NC2=NC(=NC(=N2)Cl)NC5=C(NC(=O)C)C=C(N=NC3=CC4=C(C=C3[S]([O-])(=O)=O)C=C([S]([O-])(=O)=O)C=C4[S]([O-])(=O)=O)C=C5)C6=C(C(=O)C7=C(C6=O)C=CC=C7)C(=C8[S]([O-])(=O)=O)N.[Na+].[Na+].[Na+].[Na+].[Na+]
• InChI: 1S/C41H29ClN10O18S5.5Na/c1-17(53)44-26-13-20(51-52-28-15-24-18(11-32(28)74(65,66)67)10-21(71(56,57)58)14-31(24)73(62,63)64)6-8-25(26)46-40-48-39(42)49-41(50-40)47-27-12-19(7-9-30(27)72(59,60)61)45-29-16-33(75(68,69)70)36(43)35-34(29)37(54)22-4-2-3-5-23(22)38(35)55;;;;;/h2-16,45H,43H2,1H3,(H,44,53)(H,56,57,58)(H,59,60,61)(H,62,63,64)(H,65,66,67)(H,68,69,70)(H2,46,47,48,49,50);;;;;/q;5*+1/p-5
• InChIKey: IBAMSWYXGYXUQF-UHFFFAOYSA-I