Sodium 1-Amino-9,10-Dihydro-4-[[3-[[(2-Hydroxyethyl)Amino]Sulphonyl]-4-Methylphenyl]Amino]-9,10-Dioxoanthracene-2-Sulphonate
[CAS# 40847-64-1]

Identification

• Name: Sodium 1-Amino-9,10-Dihydro-4-[[3-[[(2-Hydroxyethyl)Amino]Sulphonyl]-4-Methylphenyl]Amino]-9,10-Dioxoanthracene-2-Sulphonate
• Synonyms: Sodium 1-Amino-4-[[3-(2-Hydroxyethylsulfamoyl)-4-Methyl-Phenyl]Amino]-9,10-Dioxo-Anthracene-2-Sulfonate; Sodium 1-Amino-4-[[3-(2-Hydroxyethylsulfamoyl)-4-Methylphenyl]Amino]-9,10-Dioxo-2-Anthracenesulfonate; Sodium 1-Amino-4-[[3-(2-Hydroxyethylsulfamoyl)-4-Methyl-Phenyl]Amino]-9,10-Diketo-Anthracene-2-Sulfonate
• Molecular Formula: C₂₃H₂₀N₃NaO₈S₂
• Molecular Weight: 553.54
• CAS Registry Number: 40847-64-1
• EINECS: 255-107-7
• SMILES: C1=C([S]([O-])(=O)=O)C(=C3C(=C1NC2=CC=C(C(=C2)[S](=O)(=O)NCCO)C)C(=O)C4=C(C3=O)C=CC=C4)N.[Na+]
• InChI: 1S/C23H21N3O8S2.Na/c1-12-6-7-13(10-17(12)35(30,31)25-8-9-27)26-16-11-18(36(32,33)34)21(24)20-19(16)22(28)14-4-2-3-5-15(14)23(20)29;/h2-7,10-11,25-27H,8-9,24H2,1H3,(H,32,33,34);/q;+1/p-1
• InChIKey: KGFQWQPBSFDQQE-UHFFFAOYSA-M