benzene-1,2-diol; iron

Systemtic Name: benzene-1,2-diol; iron Openeye Name: benzene-1,2-diol; iron CAS Name: benzene-1,2-diol; iron IUPAC Name: benzene-1,2-diol; iron Traditional Name: iron; pyrocatechol Formula: C18H18FeO6 MolecularWeight: 386.17692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)O)O.C1=CC=C(C(=C1)O)O.C1=CC=C(C(=C1)O)O.[Fe]

Isomeric SMILES

C1=CC=C(C(=C1)O)O.C1=CC=C(C(=C1)O)O.C1=CC=C(C(=C1)O)O.[Fe]

InChI

InChI=1S/3C6H6O2.Fe/c3*7-5-3-1-2-4-6(5)8;/h3*1-4,7-8H;