Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/H3O4P.13O.3Zr/c1-5(2,3)4;;;;;;;;;;;;;;;;/h(H3,1,2,3,4);;;;;;;;;;;;;;;;/q;;;;9*-1;4*+1/p-3 |
InChIKey | InChI | 1.03 | WBTZCCQRTTWINH-UHFFFAOYSA-K |
SMILES_CANONICAL | CACTVS | 3.370 | [O-][Zr]123([O-])([O-])O[P]4(=O)O[Zr]5([O-])([O-])([O-])(O1)O[Zr]([O-])([O-])([O-])(O4)(O2)[O+]35 |
SMILES | CACTVS | 3.370 | [O-][Zr]123([O-])([O-])O[P]4(=O)O[Zr]5([O-])([O-])([O-])(O1)O[Zr]([O-])([O-])([O-])(O4)(O2)[O+]35 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | [O-][Zr]123(OP4(=O)O[Zr]5(O1)([O+]2[Zr](O4)(O3)(O5)([O-])([O-])[O-])([O-])([O-])[O-])([O-])[O-] |
SMILES | OpenEye OEToolkits | 1.7.2 | [O-][Zr]123(OP4(=O)O[Zr]5(O1)([O+]2[Zr](O4)(O3)(O5)([O-])([O-])[O-])([O-])([O-])[O-])([O-])[O-] |