MOLI000370

Molecular Formula: C13H13GdN3O4+


InChI: InChI=1/C13H15N3O4.Gd/c17-12(18)8-15(9-13(19)20)5-6-16-7-10-3-1-2-4-11(10)14-16;/h1-4,7H,5-6,8-9H2,(H,17,18)(H,19,20);/q;+3/p-2/fC13H13N3O4.Gd/q-2;m

InChIKey: InChIKey=NPKMIIJSDCWDQG-AAAMXPTECN
SMILES: C1=CC2=CN(N=C2C=C1)CCN(CC(=O)[O-])CC(=O)[O-].[Gd+3]

Names:
    MOLI000370
    2-(carboxylatomethyl-(2-indazol-2-ylethyl)amino)acetate; gadolinium(+3) cation

Registries:
    PubChem CID 450002
    PubChem ID 359