NSC80585

Molecular Formula: C₁₃H₂₁NO₈S₂

InChI: InChI=1/C12H17NO5S.CH4O3S/c1-19(15,16)18-8-7-11(13)9-17-12(14)10-5-3-2-4-6-10;1-5(2,3)4/h2-6,11H,7-9,13H2,1H3;1H3,(H,2,3,4)/f/h;2H

InChIKey: InChIKey=JCDNBLNQBWSEQD-BAUHCGJDCH
SMILES: CS(=O)(=O)O.CS(=O)(=O)OCCC(COC(=O)C1=CC=CC=C1)N

Names:
    NSC80585
    (2-amino-4-methylsulfonyloxy-butyl) benzoate; methanesulfonic acid

Registries:
    PubChem CID 255237
    PubChem ID 119941