zinc N-phenyl-4-[15-(4-phenylazanylphenyl)porphyrin-22,23-diid-5-yl]aniline

Systemtic Name: zinc N-phenyl-4-[15-(4-phenylazanylphenyl)porphyrin-22,23-diid-5-yl]aniline Openeye Name: zinc 4-[15-(4-anilinophenyl)porphyrin-22,23-diid-5-yl]-N-phenyl-aniline CAS Name: zinc 4-[15-(4-anilinophenyl)-5-porphyrin-22,23-diidyl]-N-phenylaniline IUPAC Name: zinc 4-[15-(4-anilinophenyl)porphyrin-22,23-diid-5-yl]-N-phenylaniline Traditional Name: zinc [4-[15-(4-anilinophenyl)porphine-22,23-diid-5-yl]phenyl]-phenyl-amine Formula: C44H30N6Zn MolecularWeight: 708.1582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC=C(C=C2)C3=C4C=CC(=CC5=CC=C([N-]5)C(=C6C=CC(=N6)C=C7C=CC3=N7)C8=CC=C(C=C8)NC9=CC=CC=C9)[N-]4.[Zn+2]

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC=C(C=C2)C3=C4C=CC(=CC5=CC=C([N-]5)C(=C6C=CC(=N6)C=C7C=CC3=N7)C8=CC=C(C=C8)NC9=CC=CC=C9)[N-]4.[Zn+2]

InChI

InChI=1S/C44H30N6.Zn/c1-3-7-31(8-4-1)45-33-15-11-29(12-16-33)43-39-23-19-35(47-39)27-37-21-25-41(49-37)44(42-26-22-38(50-42)28-36-20-24-40(43)48-36)30-13-17-34(18-14-30)46-32-9-5-2-6-10-32;/h1-28,45-46H;/q-2;+2