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

Molecular Formula: C27H29NaO5S


InChI: InChI=1/C27H30O5S.Na/c1-15(2)19-13-22(17(5)11-24(19)28)27(21-9-7-8-10-26(21)33(30,31)32-27)23-14-20(16(3)4)25(29)12-18(23)6;/h7-16,28-29H,1-6H3;/q;+1/p-1/fC27H29O5S.Na/h28h;/q-1;m

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

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

Registries:
    PubChem CID 112884
    PubChem ID 10235885