2-(4,6-dimethoxypyrimidin-2-yl)oxy-3,3-dimethyl-butanoate; iron(3+)

Systemtic Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-3,3-dimethyl-butanoate; iron(3+) Openeye Name: ferric 2-(4,6-dimethoxypyrimidin-2-yl)oxy-3,3-dimethyl-butanoate CAS Name: 2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-3,3-dimethylbutanoate; iron(3+) IUPAC Name: 2-(4,6-dimethoxypyrimidin-2-yl)oxy-3,3-dimethylbutanoate; iron(3+) Traditional Name: ferric 2-(4,6-dimethoxypyrimidin-2-yl)oxy-3,3-dimethyl-butyrate Formula: C12H17FeN2O5+2 MolecularWeight: 325.11878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)[O-])OC1=NC(=CC(=N1)OC)OC.[Fe+3]

Isomeric SMILES

CC(C)(C)C(C(=O)[O-])OC1=NC(=CC(=N1)OC)OC.[Fe+3]

InChI

InChI=1S/C12H18N2O5.Fe/c1-12(2,3)9(10(15)16)19-11-13-7(17-4)6-8(14-11)18-5;/h6,9H,1-5H3,(H,15,16);/q;+3/p-1