iron(3+); 2-methoxy-6-[(4-methoxyphenyl)iminomethyl]phenolate

Systemtic Name: iron(3+); 2-methoxy-6-[(4-methoxyphenyl)iminomethyl]phenolate Openeye Name: ferric 2-methoxy-6-[(4-methoxyphenyl)iminomethyl]phenolate CAS Name: iron(3+); 2-methoxy-6-[(4-methoxyphenyl)iminomethyl]phenolate IUPAC Name: iron(3+); 2-methoxy-6-[(4-methoxyphenyl)iminomethyl]phenolate Traditional Name: ferric 2-methoxy-6-[(4-methoxyphenyl)iminomethyl]phenolate Formula: C45H42FeN3O9 MolecularWeight: 824.67468

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N=CC2=C(C(=CC=C2)OC)[O-].COC1=CC=C(C=C1)N=CC2=C(C(=CC=C2)OC)[O-].COC1=CC=C(C=C1)N=CC2=C(C(=CC=C2)OC)[O-].[Fe+3]

Isomeric SMILES

COC1=CC=C(C=C1)N=CC2=C(C(=CC=C2)OC)[O-].COC1=CC=C(C=C1)N=CC2=C(C(=CC=C2)OC)[O-].COC1=CC=C(C=C1)N=CC2=C(C(=CC=C2)OC)[O-].[Fe+3]

InChI

InChI=1S/3C15H15NO3.Fe/c3*1-18-13-8-6-12(7-9-13)16-10-11-4-3-5-14(19-2)15(11)17;/h3*3-10,17H,1-2H3;/q;;;+3/p-3