zinc 5-(1,3-diethylimidazol-2-ylidene)-15-phenyl-porphyrin-22-ide iodide

Systemtic Name: zinc 5-(1,3-diethylimidazol-2-ylidene)-15-phenyl-porphyrin-22-ide iodide Openeye Name: zinc 5-(1,3-diethylimidazol-2-ylidene)-15-phenyl-porphyrin-22-ide iodide CAS Name: zinc 5-(1,3-diethyl-2-imidazolylidene)-15-phenylporphyrin-22-ide iodide IUPAC Name: zinc 5-(1,3-diethylimidazol-2-ylidene)-15-phenylporphyrin-22-ide iodide Traditional Name: zinc 5-(1,3-diethyl-4-imidazolin-2-ylidene)-15-phenyl-porphin-22-ide iodide Formula: C33H27IN6Zn MolecularWeight: 699.92115

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CN(C1=C2C3=NC(=CC4=NC(=C(C5=NC(=CC6=CC=C2[N-]6)C=C5)C7=CC=CC=C7)C=C4)C=C3)CC.[Zn+2].[I-]

Isomeric SMILES

CCN1C=CN(C1=C2C3=NC(=CC4=NC(=C(C5=NC(=CC6=CC=C2[N-]6)C=C5)C7=CC=CC=C7)C=C4)C=C3)CC.[Zn+2].[I-]

InChI

InChI=1S/C33H27N6.HI.Zn/c1-3-38-18-19-39(4-2)33(38)32-29-16-12-25(36-29)20-23-10-14-27(34-23)31(22-8-6-5-7-9-22)28-15-11-24(35-28)21-26-13-17-30(32)37-26;;/h5-21H,3-4H2,1-2H3;1H;/q-1;;+2/p-1