15-(9,10-dimethoxyphenanthren-1-yl)-5,10,20-triphenyl-21,22-dihydroporphyrin

Systemtic Name: 15-(9,10-dimethoxyphenanthren-1-yl)-5,10,20-triphenyl-21,22-dihydroporphyrin Openeye Name: 15-(9,10-dimethoxy-1-phenanthryl)-5,10,20-triphenyl-21,22-dihydroporphyrin CAS Name: 15-(9,10-dimethoxy-1-phenanthrenyl)-5,10,20-triphenyl-21,22-dihydroporphyrin IUPAC Name: 15-(9,10-dimethoxyphenanthren-1-yl)-5,10,20-triphenyl-21,22-dihydroporphyrin Traditional Name: 15-(9,10-dimethoxy-1-phenanthryl)-5,10,20-triphenyl-21,22-dihydroporphine Formula: C54H38N4O2 MolecularWeight: 774.90512

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=CC=C2C3=C4C=CC(=N4)C(=C5C=CC(=C(C6=CC=C(N6)C(=C7C=CC3=N7)C8=CC=CC=C8)C9=CC=CC=C9)N5)C2=CC=CC=C2)C2=CC=CC=C21)OC

Isomeric SMILES

COC1=C(C2=C(C=CC=C2C3=C4C=CC(=N4)C(=C5C=CC(=C(C6=CC=C(N6)C(=C7C=CC3=N7)C8=CC=CC=C8)C9=CC=CC=C9)N5)C2=CC=CC=C2)C2=CC=CC=C21)OC

InChI

InChI=1S/C54H38N4O2/c1-59-53-38-22-13-12-21-36(38)37-23-14-24-39(51(37)54(53)60-2)52-46-31-29-44(57-46)49(34-17-8-4-9-18-34)42-27-25-40(55-42)48(33-15-6-3-7-16-33)41-26-28-43(56-41)50(35-19-10-5-11-20-35)45-30-32-47(52)58-45/h3-32,55-56H,1-2H3