zinc N5,N15,10,20-tetraphenylporphyrin-22,24-diide-5,15-diamine

Systemtic Name: zinc N5,N15,10,20-tetraphenylporphyrin-22,24-diide-5,15-diamine Openeye Name: zinc N5,N15,10,20-tetraphenylporphyrin-22,24-diide-5,15-diamine CAS Name: zinc N5,N15,10,20-tetraphenylporphyrin-22,24-diide-5,15-diamine IUPAC Name: zinc 5-N,15-N,10,20-tetraphenylporphyrin-22,24-diide-5,15-diamine Traditional Name: zinc (15-anilino-10,20-diphenyl-porphine-22,24-diid-5-yl)-phenyl-amine Formula: C44H30N6Zn MolecularWeight: 708.1582

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC(=C(C4=NC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)NC7=CC=CC=C7)C8=CC=CC=C8)C=C4)NC9=CC=CC=C9)[N-]3.[Zn+2]

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC(=C(C4=NC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)NC7=CC=CC=C7)C8=CC=CC=C8)C=C4)NC9=CC=CC=C9)[N-]3.[Zn+2]

InChI

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