Sodium 1-Amino-4-[[3-[(2-Chloroacetyl)Amino]Phenyl]Amino]-9,10-Dioxoanthracene-2-Sulfonate
[CAS# 75268-68-7]

Identification

• Name: Sodium 1-Amino-4-[[3-[(2-Chloroacetyl)Amino]Phenyl]Amino]-9,10-Dioxoanthracene-2-Sulfonate
• Synonyms: Sodium 1-Amino-4-[[3-[(2-Chloroacetyl)Amino]Phenyl]Amino]-9,10-Dioxo-Anthracene-2-Sulfonate; Sodium 1-Amino-4-[[3-[(2-Chloro-1-Oxoethyl)Amino]Phenyl]Amino]-9,10-Dioxo-2-Anthracenesulfonate; Sodium 1-Amino-4-[[3-[(2-Chloroacetyl)Amino]Phenyl]Amino]-9,10-Diketo-Anthracene-2-Sulfonate
• Molecular Formula: C₂₂H₁₅ClN₃NaO₆S
• Molecular Weight: 507.88
• CAS Registry Number: 75268-68-7
• EINECS: 278-157-1
• SMILES: C1=C([S]([O-])(=O)=O)C(=C3C(=C1NC2=CC=CC(=C2)NC(=O)CCl)C(=O)C4=C(C3=O)C=CC=C4)N.[Na+]
• InChI: 1S/C22H16ClN3O6S.Na/c23-10-17(27)26-12-5-3-4-11(8-12)25-15-9-16(33(30,31)32)20(24)19-18(15)21(28)13-6-1-2-7-14(13)22(19)29;/h1-9,25H,10,24H2,(H,26,27)(H,30,31,32);/q;+1/p-1
• InChIKey: YWTKOICHRYFLKQ-UHFFFAOYSA-M