Sodium 1-amino-4-{[3-(benzoylamino)phenyl]amino}-9,10-dioxo-9,10-dihydro-2-anthracenesulfonate
[CAS# 70571-78-7]

Identification

• Name: Sodium 1-amino-4-{[3-(benzoylamino)phenyl]amino}-9,10-dioxo-9,10-dihydro-2-anthracenesulfonate
• Synonyms: 2-Anthracenesulfonic acid, 1-amino-4-[[3-(benzoylamino)phenyl]amino]-9,10-dihydro-9,10-dioxo-, monosodium salt
• Molecular Formula: C₂₇H₁₈N₃NaO₆S
• Molecular Weight: 535.50
• CAS Registry Number: 70571-78-7
• SMILES: c1ccc(cc1)C(=O)Nc2cccc(c2)Nc3cc(c(c4c3C(=O)c5ccccc5C4=O)N)S(=O)(=O)[O-].[Na+]
• InChI: 1S/C27H19N3O6S.Na/c28-24-21(37(34,35)36)14-20(22-23(24)26(32)19-12-5-4-11-18(19)25(22)31)29-16-9-6-10-17(13-16)30-27(33)15-7-2-1-3-8-15;/h1-14,29H,28H2,(H,30,33)(H,34,35,36);/q;+1/p-1
• InChIKey: ZTHSLXROSAKUNG-UHFFFAOYSA-M