zinc 2-[4-[12-(4-iodophenyl)-8,8-dimethyl-15-(4-methylphenyl)-7H-porphyrin-23,24-diid-2-yl]phenyl]ethynyl-trimethyl-silane

Systemtic Name: zinc 2-[4-[12-(4-iodophenyl)-8,8-dimethyl-15-(4-methylphenyl)-7H-porphyrin-23,24-diid-2-yl]phenyl]ethynyl-trimethyl-silane Openeye Name: zinc 2-[4-[12-(4-iodophenyl)-8,8-dimethyl-15-(p-tolyl)-7H-porphyrin-23,24-diid-2-yl]phenyl]ethynyl-trimethyl-silane CAS Name: zinc 2-[4-[12-(4-iodophenyl)-8,8-dimethyl-15-(4-methylphenyl)-7H-porphyrin-23,24-diid-2-yl]phenyl]ethynyl-trimethylsilane IUPAC Name: zinc 2-[4-[12-(4-iodophenyl)-8,8-dimethyl-15-(4-methylphenyl)-7H-porphyrin-23,24-diid-2-yl]phenyl]ethynyl-trimethylsilane Traditional Name: zinc 2-[4-[12-(4-iodophenyl)-8,8-dimethyl-15-(p-tolyl)-7H-porphine-23,24-diid-2-yl]phenyl]ethynyl-trimethyl-silane Formula: C46H39IN4SiZn MolecularWeight: 868.22763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C3C=CC(=CC4=NC(=CC5=NC(=CC6=C(C=C2[N-]6)C7=CC=C(C=C7)I)C(C5)(C)C)C=C4C8=CC=C(C=C8)C#C[Si](C)(C)C)[N-]3.[Zn+2]

Isomeric SMILES

CC1=CC=C(C=C1)C2=C3C=CC(=CC4=NC(=CC5=NC(=CC6=C(C=C2[N-]6)C7=CC=C(C=C7)I)C(C5)(C)C)C=C4C8=CC=C(C=C8)C#C[Si](C)(C)C)[N-]3.[Zn+2]

InChI

InChI=1S/C46H39IN4Si.Zn/c1-29-7-11-33(12-8-29)45-40-20-19-35(48-40)25-41-38(31-13-9-30(10-14-31)21-22-52(4,5)6)24-36(49-41)23-37-28-46(2,3)44(50-37)27-42-39(26-43(45)51-42)32-15-17-34(47)18-16-32;/h7-20,23-27H,28H2,1-6H3;/q-2;+2