Ethyl-beta-chloroethyl-ethylenimonium picrylsulfonate

Molecular Formula: C12H15ClN4O9S


InChI: InChI=1/C6H12ClN.C6H3N3O9S/c1-2-6-5-8(6)4-3-7;10-7(11)3-1-4(8(12)13)6(19(16,17)18)5(2-3)9(14)15/h6H,2-5H2,1H3;1-2H,(H,16,17,18)/fC6H13ClN.C6H2N3O9S/h8H;/q+1;-1

InChIKey: InChIKey=PWYBTCCLIGLZDR-GBTVBCLUCO
SMILES: CCC1C[NH+]1CCCl.C1=C(C=C(C(=C1[N+](=O)[O-])S(=O)(=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Names:
    ETHYLENIMONIUM, ETHYL(2-CHLOROETHYL)-, PICRYLSULFONATE
    Ethyl-beta-chloroethyl-ethylenimonium picrylsulfonate
    1-Ethyl-1-(beta-chloroethyl)ethylenimonium picrylsulfonate
    1-(2-chloroethyl)-2-ethyl-1-azoniacyclopropane; 2,4,6-trinitrobenzenesulfonate
    63918-55-8

Registries:
    PubChem CID 45432
    PubChem ID 185352