zinc 2-[7,7-dimethyl-12-[2-tri(propan-2-yl)silylethynyl]-8H-porphyrin-23,24-diid-2-yl]ethynyl-tri(propan-2-yl)silane

Systemtic Name: zinc 2-[7,7-dimethyl-12-[2-tri(propan-2-yl)silylethynyl]-8H-porphyrin-23,24-diid-2-yl]ethynyl-tri(propan-2-yl)silane Openeye Name: zinc 2-[7,7-dimethyl-12-(2-triisopropylsilylethynyl)-8H-porphyrin-23,24-diid-2-yl]ethynyl-triisopropyl-silane CAS Name: zinc 2-[7,7-dimethyl-12-[2-tri(propan-2-yl)silylethynyl]-8H-porphyrin-23,24-diid-2-yl]ethynyl-tri(propan-2-yl)silane IUPAC Name: zinc 2-[7,7-dimethyl-12-[2-tri(propan-2-yl)silylethynyl]-8H-porphyrin-23,24-diid-2-yl]ethynyl-tri(propan-2-yl)silane Traditional Name: zinc 2-[7,7-dimethyl-12-(2-triisopropylsilylethynyl)-8H-porphine-23,24-diid-2-yl]ethynyl-triisopropyl-silane Formula: C44H58N4Si2Zn MolecularWeight: 764.53812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)[Si](C#CC1=CC2=CC3=NC(=CC4=C(C=C([N-]4)C=C5C=CC(=CC1=N2)[N-]5)C#C[Si](C(C)C)(C(C)C)C(C)C)CC3(C)C)(C(C)C)C(C)C.[Zn+2]

Isomeric SMILES

CC(C)[Si](C#CC1=CC2=CC3=NC(=CC4=C(C=C([N-]4)C=C5C=CC(=CC1=N2)[N-]5)C#C[Si](C(C)C)(C(C)C)C(C)C)CC3(C)C)(C(C)C)C(C)C.[Zn+2]

InChI

InChI=1S/C44H58N4Si2.Zn/c1-28(2)49(29(3)4,30(5)6)19-17-34-21-38-23-36-15-16-37(45-36)24-41-35(18-20-50(31(7)8,32(9)10)33(11)12)22-39(47-41)26-43-44(13,14)27-40(48-43)25-42(34)46-38;/h15-16,21-26,28-33H,27H2,1-14H3;/q-2;+2