NSC61561

Molecular Formula: C₂₃H₂₂Cl₂N₄O₉

InChI: InChI=1/C17H19Cl2NO2.C6H3N3O7/c1-10-4-11(2)16(21)12(5-10)8-20(3)9-13-6-14(18)7-15(19)17(13)22;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h4-7,21-22H,8-9H2,1-3H3;1-2,10H

InChIKey: InChIKey=HTMXOCCIZHVVPI-UHFFFAOYAV
SMILES: CC1=CC(=C(C(=C1)CN(C)CC2=CC(=CC(=C2O)Cl)Cl)O)C.C1=C(C=C(C(=C1[N+](=O)[O-])O)[N+](=O)[O-])[N+](=O)[O-]

Names:
    NSC61561
    2-[[(3,5-dichloro-2-hydroxy-phenyl)methyl-methyl-amino]methyl]-4,6-dimethyl-phenol; 2,4,6-trinitrophenol

Registries:
    PubChem CID 247198
    PubChem ID 109000