5-nitro-2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]benzenesulfonic acid

Molecular Formula: C20H25NO6S


InChI: InChI=1/C20H25NO6S/c1-19(2,3)13-20(4,5)14-6-9-16(10-7-14)27-17-11-8-15(21(22)23)12-18(17)28(24,25)26/h6-12H,13H2,1-5H3,(H,24,25,26)/f/h24H

InChIKey: InChIKey=WCDGUQYZUYGEED-LQFNOIFHCJ
SMILES: CC(C)(C)CC(C)(C)C1=CC=C(C=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)O

Names:
    5-nitro-2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]benzenesulfonic acid

Registries:
    PubChem CID 292317
    PubChem ID 6078316