zinc trimethyl-[2-[3-(2-trimethylsilylethynyl)-2-[10,15,20-tris(2,4,6-trimethylphenyl)porphyrin-23,24-diid-5-yl]phenyl]ethynyl]silane

Systemtic Name: zinc trimethyl-[2-[3-(2-trimethylsilylethynyl)-2-[10,15,20-tris(2,4,6-trimethylphenyl)porphyrin-23,24-diid-5-yl]phenyl]ethynyl]silane Openeye Name: zinc trimethyl-[2-[3-(2-trimethylsilylethynyl)-2-[10,15,20-tris(2,4,6-trimethylphenyl)porphyrin-23,24-diid-5-yl]phenyl]ethynyl]silane CAS Name: zinc trimethyl-[2-[3-(2-trimethylsilylethynyl)-2-[10,15,20-tris(2,4,6-trimethylphenyl)-5-porphyrin-23,24-diidyl]phenyl]ethynyl]silane IUPAC Name: zinc trimethyl-[2-[3-(2-trimethylsilylethynyl)-2-[10,15,20-tris(2,4,6-trimethylphenyl)porphyrin-23,24-diid-5-yl]phenyl]ethynyl]silane Traditional Name: zinc trimethyl-[2-[2-(10,15,20-trimesitylporphine-23,24-diid-5-yl)-3-(2-trimethylsilylethynyl)phenyl]ethynyl]silane Formula: C63H62N4Si2Zn MolecularWeight: 996.77318

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Descriptors Computed from Structure

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=CC=C7C#C[Si](C)(C)C)C#C[Si](C)(C)C)C8=C(C=C(C=C8C)C)C)C9=C(C=C(C=C9C)C)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=CC=C7C#C[Si](C)(C)C)C#C[Si](C)(C)C)C8=C(C=C(C=C8C)C)C)C9=C(C=C(C=C9C)C)C)[N-]3)C.[Zn+2]

InChI

InChI=1S/C63H62N4Si2.Zn/c1-37-31-40(4)56(41(5)32-37)60-48-19-21-50(64-48)61(57-42(6)33-38(2)34-43(57)7)52-23-25-54(66-52)63(59-46(27-29-68(10,11)12)17-16-18-47(59)28-30-69(13,14)15)55-26-24-53(67-55)62(51-22-20-49(60)65-51)58-44(8)35-39(3)36-45(58)9;/h16-26,31-36H,1-15H3;/q-2;+2