zinc 2-[2,3,7,8,12,13,17,18-octaethyl-10,15,20-tris[2-tri(propan-2-yl)silylethynyl]porphyrin-21,22-diid-5-yl]ethynyl-tri(propan-2-yl)silane

Systemtic Name: zinc 2-[2,3,7,8,12,13,17,18-octaethyl-10,15,20-tris[2-tri(propan-2-yl)silylethynyl]porphyrin-21,22-diid-5-yl]ethynyl-tri(propan-2-yl)silane Openeye Name: zinc triisopropyl-[2-[2,3,7,8,12,13,17,18-octaethyl-10,15,20-tris(2-triisopropylsilylethynyl)porphyrin-21,22-diid-5-yl]ethynyl]silane CAS Name: zinc 2-[2,3,7,8,12,13,17,18-octaethyl-10,15,20-tris[2-tri(propan-2-yl)silylethynyl]-5-porphyrin-21,22-diidyl]ethynyl-tri(propan-2-yl)silane IUPAC Name: zinc 2-[2,3,7,8,12,13,17,18-octaethyl-10,15,20-tris[2-tri(propan-2-yl)silylethynyl]porphyrin-21,22-diid-5-yl]ethynyl-tri(propan-2-yl)silane Traditional Name: zinc triisopropyl-[2-[2,3,7,8,12,13,17,18-octaethyl-10,15,20-tris(2-triisopropylsilylethynyl)porphine-21,22-diid-5-yl]ethynyl]silane Formula: C80H124N4Si4Zn MolecularWeight: 1319.61836

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C3=NC(=C(C4=NC(=C(C5=C(C(=C([N-]5)C(=C1[N-]2)C#C[Si](C(C)C)(C(C)C)C(C)C)CC)CC)C#C[Si](C(C)C)(C(C)C)C(C)C)C(=C4CC)CC)C#C[Si](C(C)C)(C(C)C)C(C)C)C(=C3CC)CC)C#C[Si](C(C)C)(C(C)C)C(C)C)CC.[Zn+2]

Isomeric SMILES

CCC1=C(C2=C(C3=NC(=C(C4=NC(=C(C5=C(C(=C([N-]5)C(=C1[N-]2)C#C[Si](C(C)C)(C(C)C)C(C)C)CC)CC)C#C[Si](C(C)C)(C(C)C)C(C)C)C(=C4CC)CC)C#C[Si](C(C)C)(C(C)C)C(C)C)C(=C3CC)CC)C#C[Si](C(C)C)(C(C)C)C(C)C)CC.[Zn+2]

InChI

InChI=1S/C80H124N4Si4.Zn/c1-33-61-62(34-2)74-70(42-46-86(52(15)16,53(17)18)54(19)20)76-65(37-5)66(38-6)78(83-76)72(44-48-88(58(27)28,59(29)30)60(31)32)80-68(40-8)67(39-7)79(84-80)71(43-47-87(55(21)22,56(23)24)57(25)26)77-64(36-4)63(35-3)75(82-77)69(73(61)81-74)41-45-85(49(9)10,50(11)12)51(13)14;/h49-60H,33-40H2,1-32H3;/q-2;+2