Sodium 1-Amino-4-[[3-[[(Chloroacetyl)Amino]Methyl]-2,4,6-Trimethylphenyl]Amino]-9,10-Dihydro-9,10-Dioxoanthracene-2-Sulphonate
[CAS# 70209-96-0]

Identification

• Name: Sodium 1-Amino-4-[[3-[[(Chloroacetyl)Amino]Methyl]-2,4,6-Trimethylphenyl]Amino]-9,10-Dihydro-9,10-Dioxoanthracene-2-Sulphonate
• Synonyms: Sodium 1-Amino-4-[[3-[[(2-Chloroacetyl)Amino]Methyl]-2,4,6-Trimethyl-Phenyl]Amino]-9,10-Dioxo-Anthracene-2-Sulfonate; Sodium 1-Amino-4-[[3-[[(2-Chloro-1-Oxoethyl)Amino]Methyl]-2,4,6-Trimethylphenyl]Amino]-9,10-Dioxo-2-Anthracenesulfonate; Sodium 1-Amino-4-[[3-[[(2-Chloroacetyl)Amino]Methyl]-2,4,6-Trimethyl-Phenyl]Amino]-9,10-Diketo-Anthracene-2-Sulfonate
• Molecular Formula: C₂₆H₂₃ClN₃NaO₆S
• Molecular Weight: 563.99
• CAS Registry Number: 70209-96-0
• EINECS: 274-393-4
• SMILES: C1=C([S]([O-])(=O)=O)C(=C3C(=C1NC2=C(C=C(C(=C2C)CNC(=O)CCl)C)C)C(=O)C4=C(C3=O)C=CC=C4)N.[Na+]
• InChI: 1S/C26H24ClN3O6S.Na/c1-12-8-13(2)24(14(3)17(12)11-29-20(31)10-27)30-18-9-19(37(34,35)36)23(28)22-21(18)25(32)15-6-4-5-7-16(15)26(22)33;/h4-9,30H,10-11,28H2,1-3H3,(H,29,31)(H,34,35,36);/q;+1/p-1
• InChIKey: UWJYABMDWCUUTF-UHFFFAOYSA-M