cyclohexane; 2-(iminomethyl)phenolate; iron(3+); chloride

Systemtic Name: cyclohexane; 2-(iminomethyl)phenolate; iron(3+); chloride Openeye Name: ferric; cyclohexane; 2-methanimidoylphenolate; chloride CAS Name: cyclohexane; iron(3+); 2-methanimidoylphenolate; chloride IUPAC Name: cyclohexane; iron(3+); 2-methanimidoylphenolate; chloride Traditional Name: ferric; cyclohexane; 2-formimidoylphenolate; chloride Formula: C20H24ClFeN2O2 MolecularWeight: 415.71476

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCC1.C1=CC=C(C(=C1)C=N)[O-].C1=CC=C(C(=C1)C=N)[O-].[Cl-].[Fe+3]

Isomeric SMILES

C1CCCCC1.C1=CC=C(C(=C1)C=N)[O-].C1=CC=C(C(=C1)C=N)[O-].[Cl-].[Fe+3]

InChI

InChI=1S/2C7H7NO.C6H12.ClH.Fe/c2*8-5-6-3-1-2-4-7(6)9;1-2-4-6-5-3-1;;/h2*1-5,8-9H;1-6H2;1H;/q;;;;+3/p-3