zinc trimethyl-[2-[4-[10-(2,4,6-trimethylphenyl)-15,20-bis[4-(2-trimethylsilylethynyl)phenyl]porphyrin-22,23-diid-5-yl]phenyl]ethynyl]silane

Systemtic Name: zinc trimethyl-[2-[4-[10-(2,4,6-trimethylphenyl)-15,20-bis[4-(2-trimethylsilylethynyl)phenyl]porphyrin-22,23-diid-5-yl]phenyl]ethynyl]silane Openeye Name: zinc trimethyl-[2-[4-[10-(2,4,6-trimethylphenyl)-15,20-bis[4-(2-trimethylsilylethynyl)phenyl]porphyrin-22,23-diid-5-yl]phenyl]ethynyl]silane CAS Name: zinc trimethyl-[2-[4-[10-(2,4,6-trimethylphenyl)-15,20-bis[4-(2-trimethylsilylethynyl)phenyl]-5-porphyrin-22,23-diidyl]phenyl]ethynyl]silane IUPAC Name: zinc trimethyl-[2-[4-[10-(2,4,6-trimethylphenyl)-15,20-bis[4-(2-trimethylsilylethynyl)phenyl]porphyrin-22,23-diid-5-yl]phenyl]ethynyl]silane Traditional Name: zinc 2-[4-[10-mesityl-15,20-bis[4-(2-trimethylsilylethynyl)phenyl]porphine-22,23-diid-5-yl]phenyl]ethynyl-trimethyl-silane Formula: C62H58N4Si3Zn MolecularWeight: 1008.81622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C2=C3C=CC(=C(C4=NC(=C(C5=NC(=C(C6=CC=C2[N-]6)C7=CC=C(C=C7)C#C[Si](C)(C)C)C=C5)C8=CC=C(C=C8)C#C[Si](C)(C)C)C=C4)C9=CC=C(C=C9)C#C[Si](C)(C)C)[N-]3)C.[Zn+2]

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C2=C3C=CC(=C(C4=NC(=C(C5=NC(=C(C6=CC=C2[N-]6)C7=CC=C(C=C7)C#C[Si](C)(C)C)C=C5)C8=CC=C(C=C8)C#C[Si](C)(C)C)C=C4)C9=CC=C(C=C9)C#C[Si](C)(C)C)[N-]3)C.[Zn+2]

InChI

InChI=1S/C62H58N4Si3.Zn/c1-41-39-42(2)58(43(3)40-41)62-56-31-29-54(65-56)60(48-21-15-45(16-22-48)34-37-68(7,8)9)52-27-25-50(63-52)59(47-19-13-44(14-20-47)33-36-67(4,5)6)51-26-28-53(64-51)61(55-30-32-57(62)66-55)49-23-17-46(18-24-49)35-38-69(10,11)12;/h13-32,39-40H,1-12H3;/q-2;+2