zinc 2-iodanyl-5,15-diphenyl-10-[1,1,2,2,3,3,4,4,5,5,6,6,6-tridecakis(fluoranyl)hexyl]porphyrin-22,23-diide

Systemtic Name: zinc 2-iodanyl-5,15-diphenyl-10-[1,1,2,2,3,3,4,4,5,5,6,6,6-tridecakis(fluoranyl)hexyl]porphyrin-22,23-diide Openeye Name: zinc 2-iodo-5,15-diphenyl-10-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)porphyrin-22,23-diide CAS Name: zinc 2-iodo-5,15-diphenyl-10-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)porphyrin-22,23-diide IUPAC Name: zinc 2-iodo-5,15-diphenyl-10-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)porphyrin-22,23-diide Traditional Name: zinc 2-iodo-5,15-diphenyl-10-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)porphine-22,23-diide Formula: C38H18F13IN4Zn MolecularWeight: 969.869032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C([N-]4)C(=C5C=C(C(=N5)C=C6C=CC2=N6)I)C7=CC=CC=C7)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)[N-]3.[Zn+2]

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=CC(=C(C4=CC=C([N-]4)C(=C5C=C(C(=N5)C=C6C=CC2=N6)I)C7=CC=CC=C7)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)[N-]3.[Zn+2]

InChI

InChI=1S/C38H18F13IN4.Zn/c39-33(40,34(41,42)35(43,44)36(45,46)37(47,48)38(49,50)51)32-26-15-13-24(54-26)30(19-7-3-1-4-8-19)23-12-11-21(53-23)17-28-22(52)18-29(56-28)31(20-9-5-2-6-10-20)25-14-16-27(32)55-25;/h1-18H;/q-2;+2