zinc 5-(4-bromophenyl)-10,15,20-tripyridin-4-yl-porphyrin-23,24-diide

Systemtic Name: zinc 5-(4-bromophenyl)-10,15,20-tripyridin-4-yl-porphyrin-23,24-diide Openeye Name: zinc 5-(4-bromophenyl)-10,15,20-tris(4-pyridyl)porphyrin-23,24-diide CAS Name: zinc 5-(4-bromophenyl)-10,15,20-tripyridin-4-ylporphyrin-23,24-diide IUPAC Name: zinc 5-(4-bromophenyl)-10,15,20-tripyridin-4-ylporphyrin-23,24-diide Traditional Name: zinc 5-(4-bromophenyl)-10,15,20-tris(4-pyridyl)porphine-23,24-diide Formula: C41H24BrN7Zn MolecularWeight: 759.98916

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C3C=CC(=N3)C(=C4C=CC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)C7=CC=NC=C7)C8=CC=NC=C8)[N-]4)C9=CC=NC=C9)Br.[Zn+2]

Isomeric SMILES

C1=CC(=CC=C1C2=C3C=CC(=N3)C(=C4C=CC(=C(C5=CC=C([N-]5)C(=C6C=CC2=N6)C7=CC=NC=C7)C8=CC=NC=C8)[N-]4)C9=CC=NC=C9)Br.[Zn+2]

InChI

InChI=1S/C41H24BrN7.Zn/c42-29-3-1-25(2-4-29)38-30-5-7-32(46-30)39(26-13-19-43-20-14-26)34-9-11-36(48-34)41(28-17-23-45-24-18-28)37-12-10-35(49-37)40(27-15-21-44-22-16-27)33-8-6-31(38)47-33;/h1-24H;/q-2;+2