2-[2-(2,5-dimethylbenzo[1,3]dioxol-2-yl)ethylammonio]ethyl-diethyl-azanium; (Z)-4-hydroxy-4-oxo-but-2-enoate

Molecular Formula: C25H36N2O10


InChI: InChI=1/C17H28N2O2.2C4H4O4/c1-5-19(6-2)12-11-18-10-9-17(4)20-15-8-7-14(3)13-16(15)21-17;2*5-3(6)1-2-4(7)8/h7-8,13,18H,5-6,9-12H2,1-4H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-/fC17H30N2O2.2C4H3O4/h18-19H;2*5H/q+2;2*-1

InChIKey: InChIKey=OOWMVIPNURFSHG-DWBDPONPDE
SMILES: CC[NH+](CC)CC[NH2+]CCC1(OC2=C(O1)C=C(C=C2)C)C.C(=CC(=O)[O-])C(=O)O.C(=CC(=O)[O-])C(=O)O

Names:
    2-[2-(2,5-dimethylbenzo[1,3]dioxol-2-yl)ethylammonio]ethyl-diethyl-azanium; (Z)-4-hydroxy-4-oxo-but-2-enoate

Registries:
    PubChem CID 6434445
    PubChem ID 11621050