3-amino-4-hydroxy-5-nitro-benzenesulfonic acid hydrate

Molecular Formula: C6H8N2O7S


InChI: InChI=1/C6H6N2O6S.H2O/c7-4-1-3(15(12,13)14)2-5(6(4)9)8(10)11;/h1-2,9H,7H2,(H,12,13,14);1H2/f/h12H;

InChIKey: InChIKey=HJASIPICABEOAV-VYWOEEDOCE
SMILES: C1=C(C=C(C(=C1[N+](=O)[O-])O)N)S(=O)(=O)O.O

Names:
    3-amino-4-hydroxy-5-nitro-benzenesulfonic acid hydrate

Registries:
    PubChem CID 5712259
    PubChem ID 3252000