2-[15-(4-methoxyphenyl)-10,20-diphenyl-23,24-dihydroporphyrin-5-yl]-3-propan-2-yloxy-naphthalene-1,4-dione

Systemtic Name: 2-[15-(4-methoxyphenyl)-10,20-diphenyl-23,24-dihydroporphyrin-5-yl]-3-propan-2-yloxy-naphthalene-1,4-dione Openeye Name: 2-isopropoxy-3-[15-(4-methoxyphenyl)-10,20-diphenyl-23,24-dihydroporphyrin-5-yl]naphthalene-1,4-dione CAS Name: 2-[15-(4-methoxyphenyl)-10,20-diphenyl-23,24-dihydroporphyrin-5-yl]-3-propan-2-yloxynaphthalene-1,4-dione IUPAC Name: 2-[15-(4-methoxyphenyl)-10,20-diphenyl-23,24-dihydroporphyrin-5-yl]-3-propan-2-yloxynaphthalene-1,4-dione Traditional Name: 2-isopropoxy-3-[15-(4-methoxyphenyl)-10,20-diphenyl-23,24-dihydroporphin-5-yl]-1,4-naphthoquinone Formula: C52H38N4O4 MolecularWeight: 782.88252

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C(=O)C2=CC=CC=C2C1=O)C3=C4C=CC(=N4)C(=C5C=CC(=C(C6=CC=C(N6)C(=C7C=CC3=N7)C8=CC=CC=C8)C9=CC=C(C=C9)OC)N5)C1=CC=CC=C1

Isomeric SMILES

CC(C)OC1=C(C(=O)C2=CC=CC=C2C1=O)C3=C4C=CC(=N4)C(=C5C=CC(=C(C6=CC=C(N6)C(=C7C=CC3=N7)C8=CC=CC=C8)C9=CC=C(C=C9)OC)N5)C1=CC=CC=C1

InChI

InChI=1S/C52H38N4O4/c1-30(2)60-52-49(50(57)35-16-10-11-17-36(35)51(52)58)48-43-28-26-39(55-43)45(31-12-6-4-7-13-31)37-22-24-41(53-37)47(33-18-20-34(59-3)21-19-33)42-25-23-38(54-42)46(32-14-8-5-9-15-32)40-27-29-44(48)56-40/h4-30,53-54H,1-3H3