5,10,15,20-tetraphenyl-2-(2-propan-2-ylphenoxy)-21,22-dihydroporphyrin

Systemtic Name: 5,10,15,20-tetraphenyl-2-(2-propan-2-ylphenoxy)-21,22-dihydroporphyrin Openeye Name: 2-(2-isopropylphenoxy)-5,10,15,20-tetraphenyl-21,22-dihydroporphyrin CAS Name: 5,10,15,20-tetraphenyl-2-(2-propan-2-ylphenoxy)-21,22-dihydroporphyrin IUPAC Name: 5,10,15,20-tetraphenyl-2-(2-propan-2-ylphenoxy)-21,22-dihydroporphyrin Traditional Name: 2-(2-isopropylphenoxy)-5,10,15,20-tetraphenyl-21,22-dihydroporphine Formula: C53H40N4O MolecularWeight: 748.9109

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OC2=C3C(=C4C=CC(=N4)C(=C5C=CC(=N5)C(=C6C=CC(=C(C(=C2)N3)C7=CC=CC=C7)N6)C8=CC=CC=C8)C9=CC=CC=C9)C1=CC=CC=C1

Isomeric SMILES

CC(C)C1=CC=CC=C1OC2=C3C(=C4C=CC(=N4)C(=C5C=CC(=N5)C(=C6C=CC(=C(C(=C2)N3)C7=CC=CC=C7)N6)C8=CC=CC=C8)C9=CC=CC=C9)C1=CC=CC=C1

InChI

InChI=1S/C53H40N4O/c1-34(2)39-25-15-16-26-47(39)58-48-33-46-51(37-21-11-5-12-22-37)44-30-29-42(55-44)49(35-17-7-3-8-18-35)40-27-28-41(54-40)50(36-19-9-4-10-20-36)43-31-32-45(56-43)52(53(48)57-46)38-23-13-6-14-24-38/h3-34,55,57H,1-2H3