zinc 2-[10,20-diphenyl-15-[1,1,2,2,3,3,4,4,5,5,6,6,6-tridecakis(fluoranyl)hexyl]porphyrin-22,24-diid-5-yl]ethynyl-trimethyl-silane

Systemtic Name: zinc 2-[10,20-diphenyl-15-[1,1,2,2,3,3,4,4,5,5,6,6,6-tridecakis(fluoranyl)hexyl]porphyrin-22,24-diid-5-yl]ethynyl-trimethyl-silane Openeye Name: zinc 2-[10,20-diphenyl-15-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)porphyrin-22,24-diid-5-yl]ethynyl-trimethyl-silane CAS Name: zinc 2-[10,20-diphenyl-15-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-5-porphyrin-22,24-diidyl]ethynyl-trimethylsilane IUPAC Name: zinc 2-[10,20-diphenyl-15-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)porphyrin-22,24-diid-5-yl]ethynyl-trimethylsilane Traditional Name: zinc 2-[10,20-diphenyl-15-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)porphine-22,24-diid-5-yl]ethynyl-trimethyl-silane Formula: C43H27F13N4SiZn MolecularWeight: 940.175022

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Descriptors Computed from Structure

Canonical SMILES:

C[Si](C)(C)C#CC1=C2C=CC(=C(C3=NC(=C(C4=CC=C([N-]4)C(=C5C=CC1=N5)C6=CC=CC=C6)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C=C3)C7=CC=CC=C7)[N-]2.[Zn+2]

Isomeric SMILES

C[Si](C)(C)C#CC1=C2C=CC(=C(C3=NC(=C(C4=CC=C([N-]4)C(=C5C=CC1=N5)C6=CC=CC=C6)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C=C3)C7=CC=CC=C7)[N-]2.[Zn+2]

InChI

InChI=1S/C43H27F13N4Si.Zn/c1-61(2,3)23-22-26-27-14-16-29(57-27)35(24-10-6-4-7-11-24)31-18-20-33(59-31)37(38(44,45)39(46,47)40(48,49)41(50,51)42(52,53)43(54,55)56)34-21-19-32(60-34)36(25-12-8-5-9-13-25)30-17-15-28(26)58-30;/h4-21H,1-3H3;/q-2;+2