2-ethenylbenzoate; iron(3+)

Systemtic Name: 2-ethenylbenzoate; iron(3+) Openeye Name: ferric 2-vinylbenzoate CAS Name: 2-ethenylbenzoate; iron(3+) IUPAC Name: 2-ethenylbenzoate; iron(3+) Traditional Name: ferric 2-vinylbenzoate Formula: C27H21FeO6 MolecularWeight: 497.29704

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CC=CC=C1C(=O)[O-].C=CC1=CC=CC=C1C(=O)[O-].C=CC1=CC=CC=C1C(=O)[O-].[Fe+3]

Isomeric SMILES

C=CC1=CC=CC=C1C(=O)[O-].C=CC1=CC=CC=C1C(=O)[O-].C=CC1=CC=CC=C1C(=O)[O-].[Fe+3]

InChI

InChI=1S/3C9H8O2.Fe/c3*1-2-7-5-3-4-6-8(7)9(10)11;/h3*2-6H,1H2,(H,10,11);/q;;;+3/p-3