sodium 2,6-dibromo-4-[9-(3,5-dibromo-4-hydroxy-2-methyl-phenyl)-7,7-dioxo-8-oxa-7λ6-thiabicyclo[4.3.0]nona-1,3,5-trien-9-yl]-3-methyl-phenolate

Molecular Formula: C21H13Br4NaO5S


InChI: InChI=1/C21H14Br4O5S.Na/c1-9-12(7-14(22)19(26)17(9)24)21(13-8-15(23)20(27)18(25)10(13)2)11-5-3-4-6-16(11)31(28,29)30-21;/h3-8,26-27H,1-2H3;/q;+1/p-1/fC21H13Br4O5S.Na/h26h;/q-1;m

InChIKey: InChIKey=HEFSGAHJDGZCHA-BXTMBRTJCB
SMILES: CC1=C(C(=C(C=C1C2(C3=CC=CC=C3S(=O)(=O)O2)C4=CC(=C(C(=C4C)Br)[O-])Br)Br)O)Br.[Na+]

Names:
    sodium 2,6-dibromo-4-[9-(3,5-dibromo-4-hydroxy-2-methyl-phenyl)-7,7-dioxo-8-oxa-7λ6-thiabicyclo[4.3.0]nona-1,3,5-trien-9-yl]-3-methyl-phenolate

Registries:
    PubChem CID 106786
    PubChem ID 10234047