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zinc S-[6-[10,15,20-tris(2,4,6-trimethylphenyl)porphyrin-21,22-diid-5-yl]hexyl] ethanethioate
zinc S-[6-[10,15,20-tris(2,4,6-trimethylphenyl)porphyrin-21,22-diid-5-yl]hexyl] ethanethioate
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Canonical SMILES:
CC1=CC(=C(C(=C1)C)C2=C3C=CC(=C(C4=CC=C([N-]4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=C(C=C(C=C7C)C)C)C8=C(C=C(C=C8C)C)C)CCCCCCSC(=O)C)[N-]3)C.[Zn+2]
Isomeric SMILES
CC1=CC(=C(C(=C1)C)C2=C3C=CC(=C(C4=CC=C([N-]4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=C(C=C(C=C7C)C)C)C8=C(C=C(C=C8C)C)C)CCCCCCSC(=O)C)[N-]3)C.[Zn+2]
InChI
InChI=1S/C55H56N4OS.Zn/c1-31-25-34(4)50(35(5)26-31)53-44-18-16-42(56-44)41(15-13-11-12-14-24-61-40(10)60)43-17-19-45(57-43)54(51-36(6)27-32(2)28-37(51)7)47-21-23-49(59-47)55(48-22-20-46(53)58-48)52-38(8)29-33(3)30-39(52)9;/h16-23,25-30H,11-15,24H2,1-10H3;/q-2;+2
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