5,10,20-triphenyl-15-(4-propan-2-yloxyphenyl)-21,22-dihydroporphyrin

Systemtic Name: 5,10,20-triphenyl-15-(4-propan-2-yloxyphenyl)-21,22-dihydroporphyrin Openeye Name: 15-(4-isopropoxyphenyl)-5,10,20-triphenyl-21,22-dihydroporphyrin CAS Name: 5,10,20-triphenyl-15-(4-propan-2-yloxyphenyl)-21,22-dihydroporphyrin IUPAC Name: 5,10,20-triphenyl-15-(4-propan-2-yloxyphenyl)-21,22-dihydroporphyrin Traditional Name: 15-(4-isopropoxyphenyl)-5,10,20-triphenyl-21,22-dihydroporphine Formula: C47H36N4O MolecularWeight: 672.81494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C2=C3C=CC(=N3)C(=C4C=CC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)N4)C9=CC=CC=C9

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)C2=C3C=CC(=N3)C(=C4C=CC(=C(C5=CC=C(N5)C(=C6C=CC2=N6)C7=CC=CC=C7)C8=CC=CC=C8)N4)C9=CC=CC=C9

InChI

InChI=1S/C47H36N4O/c1-30(2)52-35-20-18-34(19-21-35)47-42-28-26-40(50-42)45(32-14-8-4-9-15-32)38-24-22-36(48-38)44(31-12-6-3-7-13-31)37-23-25-39(49-37)46(33-16-10-5-11-17-33)41-27-29-43(47)51-41/h3-30,48-49H,1-2H3