2-[10,20-bis(3,5-ditert-butylphenyl)-23,24-dihydroporphyrin-5-yl]ethynyl-trimethyl-silane

Systemtic Name: 2-[10,20-bis(3,5-ditert-butylphenyl)-23,24-dihydroporphyrin-5-yl]ethynyl-trimethyl-silane Openeye Name: 2-[10,20-bis(3,5-ditert-butylphenyl)-23,24-dihydroporphyrin-5-yl]ethynyl-trimethyl-silane CAS Name: 2-[10,20-bis(3,5-ditert-butylphenyl)-23,24-dihydroporphyrin-5-yl]ethynyl-trimethylsilane IUPAC Name: 2-[10,20-bis(3,5-ditert-butylphenyl)-23,24-dihydroporphyrin-5-yl]ethynyl-trimethylsilane Traditional Name: 2-[10,20-bis(3,5-ditert-butylphenyl)-23,24-dihydroporphin-5-yl]ethynyl-trimethyl-silane Formula: C53H62N4Si MolecularWeight: 783.17168

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)C2=C3C=CC(=CC4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C#C[Si](C)(C)C)C7=CC(=CC(=C7)C(C)(C)C)C(C)(C)C)N3)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)C2=C3C=CC(=CC4=CC=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C#C[Si](C)(C)C)C7=CC(=CC(=C7)C(C)(C)C)C(C)(C)C)N3)C(C)(C)C

InChI

InChI=1S/C53H62N4Si/c1-50(2,3)35-26-33(27-36(30-35)51(4,5)6)48-44-18-16-39(54-44)32-40-17-19-45(55-40)49(34-28-37(52(7,8)9)31-38(29-34)53(10,11)12)47-23-21-43(57-47)41(24-25-58(13,14)15)42-20-22-46(48)56-42/h16-23,26-32,54-55H,1-15H3