zinc 10-[2-chloranyl-1,1,2,2-tetrakis(fluoranyl)ethyl]-5,15-diphenyl-2-(2-phenylethynyl)porphyrin-22,23-diide

Systemtic Name: zinc 10-[2-chloranyl-1,1,2,2-tetrakis(fluoranyl)ethyl]-5,15-diphenyl-2-(2-phenylethynyl)porphyrin-22,23-diide Openeye Name: zinc 10-(2-chloro-1,1,2,2-tetrafluoro-ethyl)-5,15-diphenyl-2-(2-phenylethynyl)porphyrin-22,23-diide CAS Name: zinc 10-(2-chloro-1,1,2,2-tetrafluoroethyl)-5,15-diphenyl-2-(2-phenylethynyl)porphyrin-22,23-diide IUPAC Name: zinc 10-(2-chloro-1,1,2,2-tetrafluoroethyl)-5,15-diphenyl-2-(2-phenylethynyl)porphyrin-22,23-diide Traditional Name: zinc 10-(2-chloro-1,1,2,2-tetrafluoro-ethyl)-5,15-diphenyl-2-(2-phenylethynyl)porphine-22,23-diide Formula: C42H23ClF4N4Zn MolecularWeight: 760.514433

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CC2=CC3=C(C4=CC=C([N-]4)C(=C5C=CC(=C(C6=NC(=CC2=N3)C=C6)C7=CC=CC=C7)[N-]5)C(C(F)(F)Cl)(F)F)C8=CC=CC=C8.[Zn+2]

Isomeric SMILES

C1=CC=C(C=C1)C#CC2=CC3=C(C4=CC=C([N-]4)C(=C5C=CC(=C(C6=NC(=CC2=N3)C=C6)C7=CC=CC=C7)[N-]5)C(C(F)(F)Cl)(F)F)C8=CC=CC=C8.[Zn+2]

InChI

InChI=1S/C42H23ClF4N4.Zn/c43-42(46,47)41(44,45)40-34-22-20-32(49-34)38(27-12-6-2-7-13-27)31-19-18-30(48-31)25-36-29(17-16-26-10-4-1-5-11-26)24-37(51-36)39(28-14-8-3-9-15-28)33-21-23-35(40)50-33;/h1-15,18-25H;/q-2;+2