2-(2-hydroxyphenyl)-2-oxidanyl-ethanoate; iron(3+)

Systemtic Name: 2-(2-hydroxyphenyl)-2-oxidanyl-ethanoate; iron(3+) Openeye Name: ferric 2-hydroxy-2-(2-hydroxyphenyl)acetate CAS Name: 2-hydroxy-2-(2-hydroxyphenyl)acetate; iron(3+) IUPAC Name: 2-hydroxy-2-(2-hydroxyphenyl)acetate; iron(3+) Traditional Name: ferric 2-hydroxy-2-(2-hydroxyphenyl)acetate Formula: C24H21FeO12 MolecularWeight: 557.26134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(C(=O)[O-])O)O.C1=CC=C(C(=C1)C(C(=O)[O-])O)O.C1=CC=C(C(=C1)C(C(=O)[O-])O)O.[Fe+3]

Isomeric SMILES

C1=CC=C(C(=C1)C(C(=O)[O-])O)O.C1=CC=C(C(=C1)C(C(=O)[O-])O)O.C1=CC=C(C(=C1)C(C(=O)[O-])O)O.[Fe+3]

InChI

InChI=1S/3C8H8O4.Fe/c3*9-6-4-2-1-3-5(6)7(10)8(11)12;/h3*1-4,7,9-10H,(H,11,12);/q;;;+3/p-3