zinc 5,10,15,20-tetraphenyl-2,3-dihydroporphyrin-23,24-diid-2-ol

Systemtic Name: zinc 5,10,15,20-tetraphenyl-2,3-dihydroporphyrin-23,24-diid-2-ol Openeye Name: zinc 5,10,15,20-tetraphenyl-2,3-dihydroporphyrin-23,24-diid-2-ol CAS Name: zinc 5,10,15,20-tetraphenyl-2,3-dihydroporphyrin-23,24-diid-2-ol IUPAC Name: zinc 5,10,15,20-tetraphenyl-2,3-dihydroporphyrin-23,24-diid-2-ol Traditional Name: zinc 5,10,15,20-tetraphenyl-2,3-dihydroporphine-23,24-diid-2-ol Formula: C44H30N4OZn MolecularWeight: 696.1442

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(C3=CC=C([N-]3)C(=C4C=CC(=C(C5=NC(=C(C1=N2)C6=CC=CC=C6)C=C5)C7=CC=CC=C7)[N-]4)C8=CC=CC=C8)C9=CC=CC=C9)O.[Zn+2]

Isomeric SMILES

C1C(C2=C(C3=CC=C([N-]3)C(=C4C=CC(=C(C5=NC(=C(C1=N2)C6=CC=CC=C6)C=C5)C7=CC=CC=C7)[N-]4)C8=CC=CC=C8)C9=CC=CC=C9)O.[Zn+2]

InChI

InChI=1S/C44H30N4O.Zn/c49-39-27-38-42(30-17-9-3-10-18-30)36-24-23-34(46-36)40(28-13-5-1-6-14-28)32-21-22-33(45-32)41(29-15-7-2-8-16-29)35-25-26-37(47-35)43(44(39)48-38)31-19-11-4-12-20-31;/h1-26,39,49H,27H2;/q-2;+2