5-(4-fluoranyl-3-methyl-phenyl)-10-(4-methoxyphenyl)-15-(4-methylphenyl)-20-phenyl-21,22-dihydroporphyrin

Systemtic Name: 5-(4-fluoranyl-3-methyl-phenyl)-10-(4-methoxyphenyl)-15-(4-methylphenyl)-20-phenyl-21,22-dihydroporphyrin Openeye Name: 5-(4-fluoro-3-methyl-phenyl)-10-(4-methoxyphenyl)-20-phenyl-15-(p-tolyl)-21,22-dihydroporphyrin CAS Name: 5-(4-fluoro-3-methylphenyl)-10-(4-methoxyphenyl)-15-(4-methylphenyl)-20-phenyl-21,22-dihydroporphyrin IUPAC Name: 5-(4-fluoro-3-methylphenyl)-10-(4-methoxyphenyl)-15-(4-methylphenyl)-20-phenyl-21,22-dihydroporphyrin Traditional Name: 5-(4-fluoro-3-methyl-phenyl)-10-(4-methoxyphenyl)-20-phenyl-15-(p-tolyl)-21,22-dihydroporphine Formula: C47H35FN4O MolecularWeight: 690.805403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C3C=CC(=N3)C(=C4C=CC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)OC)C8=CC(=C(C=C8)F)C)N4)C9=CC=CC=C9

Isomeric SMILES

CC1=CC=C(C=C1)C2=C3C=CC(=N3)C(=C4C=CC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)OC)C8=CC(=C(C=C8)F)C)N4)C9=CC=CC=C9

InChI

InChI=1S/C47H35FN4O/c1-28-9-11-31(12-10-28)45-38-20-19-36(49-38)44(30-7-5-4-6-8-30)37-23-25-42(51-37)47(33-15-18-35(48)29(2)27-33)43-26-24-41(52-43)46(40-22-21-39(45)50-40)32-13-16-34(53-3)17-14-32/h4-27,51-52H,1-3H3