Sodium 2-[(3-Bromo-4-Hydroxy-5-Methylphenyl)(3-Bromo-5-Methyl-4-Oxocyclohexa-2,5-Dien-1-Ylidene)Methyl]Benzenesulphonate
[CAS# 94333-63-8]

Identification

• Name: Sodium 2-[(3-Bromo-4-Hydroxy-5-Methylphenyl)(3-Bromo-5-Methyl-4-Oxocyclohexa-2,5-Dien-1-Ylidene)Methyl]Benzenesulphonate
• Synonyms: Sodium 2-[(E)-(3-Bromo-4-Hydroxy-5-Methylphenyl)-(3-Bromo-5-Methyl-4-Oxo-1-Cyclohexa-2,5-Dienylidene)Methyl]Benzenesulfonate; Sodium 2-[(E)-(3-Bromo-4-Hydroxy-5-Methyl-Phenyl)-(3-Bromo-5-Methyl-4-Oxo-1-Cyclohexa-2,5-Dienylidene)Methyl]Benzenesulfonate; Sodi
• Molecular Formula: C₂₁H₁₅Br₂NaO₅S
• Molecular Weight: 562.20
• CAS Registry Number: 94333-63-8
• EINECS: 305-043-1
• SMILES: C1=C(C=C(C(=C1Br)O)C)\C(=C2/C=C(Br)C(C(=C2)C)=O)C3=CC=CC=C3[S]([O-])(=O)=O.[Na+]
• InChI: 1S/C21H16Br2O5S.Na/c1-11-7-13(9-16(22)20(11)24)19(14-8-12(2)21(25)17(23)10-14)15-5-3-4-6-18(15)29(26,27)28;/h3-10,24H,1-2H3,(H,26,27,28);/q;+1/p-1/b19-14+
• InChIKey: KVSJYIXUWNOWBD-UGAWPWHASA-M