iron; 4-methoxy-N-[(Z)-[1-(4-methoxyphenyl)-4-[(4-methoxyphenyl)iminomethyl]pyrrol-1-ium-3-ylidene]methyl]aniline; sulfite

Systemtic Name: iron; 4-methoxy-N-[(Z)-[1-(4-methoxyphenyl)-4-[(4-methoxyphenyl)iminomethyl]pyrrol-1-ium-3-ylidene]methyl]aniline; sulfite Openeye Name: iron; 4-methoxy-N-[(Z)-[1-(4-methoxyphenyl)-4-[(4-methoxyphenyl)iminomethyl]pyrrol-1-ium-3-ylidene]methyl]aniline; sulfite CAS Name: iron; 4-methoxy-N-[(Z)-[1-(4-methoxyphenyl)-4-[(4-methoxyphenyl)iminomethyl]-3-pyrrol-1-iumylidene]methyl]aniline; sulfite IUPAC Name: iron; 4-methoxy-N-[(Z)-[1-(4-methoxyphenyl)-4-[(4-methoxyphenyl)iminomethyl]pyrrol-1-ium-3-ylidene]methyl]aniline; sulfite Traditional Name: iron; (4-methoxyphenyl)-[(Z)-[1-(4-methoxyphenyl)-4-[(4-methoxyphenyl)iminomethyl]pyrrol-1-ium-3-ylidene]methyl]amine; sulfite Formula: C27H26FeN3O6S- MolecularWeight: 576.42184

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC=C2C=[N+](C=C2C=NC3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC.[O-]S(=O)[O-].[Fe]

Isomeric SMILES

COC1=CC=C(C=C1)N/C=C/2\C=[N+](C=C2C=NC3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC.[O-]S(=O)[O-].[Fe]

InChI

InChI=1S/C27H25N3O3.Fe.H2O3S/c1-31-25-10-4-22(5-11-25)28-16-20-18-30(24-8-14-27(33-3)15-9-24)19-21(20)17-29-23-6-12-26(32-2)13-7-23;;1-4(2)3/h4-19H,1-3H3;;(H2,1,2,3)/p-1