5,15-bis[4-ethoxy-2,3,5,6-tetrakis(fluoranyl)phenyl]-10,20-diphenyl-porphyrin-21,22-diide; palladium(2+)

Systemtic Name: 5,15-bis[4-ethoxy-2,3,5,6-tetrakis(fluoranyl)phenyl]-10,20-diphenyl-porphyrin-21,22-diide; palladium(2+) Openeye Name: 5,15-bis(4-ethoxy-2,3,5,6-tetrafluoro-phenyl)-10,20-diphenyl-porphyrin-21,22-diide; palladium(2+) CAS Name: 5,15-bis(4-ethoxy-2,3,5,6-tetrafluorophenyl)-10,20-diphenylporphyrin-21,22-diide; palladium(2+) IUPAC Name: 5,15-bis(4-ethoxy-2,3,5,6-tetrafluorophenyl)-10,20-diphenylporphyrin-21,22-diide; palladium(2+) Traditional Name: 5,15-bis(4-ethoxy-2,3,5,6-tetrafluoro-phenyl)-10,20-diphenyl-porphine-21,22-diide; palladium(2+) Formula: C48H28F8N4O2Pd MolecularWeight: 951.168746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C(C(=C1F)F)C2=C3C=CC(=C(C4=NC(=C(C5=NC(=C(C6=CC=C2[N-]6)C7=CC=CC=C7)C=C5)C8=C(C(=C(C(=C8F)F)OCC)F)F)C=C4)C9=CC=CC=C9)[N-]3)F)F.[Pd+2]

Isomeric SMILES

CCOC1=C(C(=C(C(=C1F)F)C2=C3C=CC(=C(C4=NC(=C(C5=NC(=C(C6=CC=C2[N-]6)C7=CC=CC=C7)C=C5)C8=C(C(=C(C(=C8F)F)OCC)F)F)C=C4)C9=CC=CC=C9)[N-]3)F)F.[Pd+2]

InChI

InChI=1S/C48H28F8N4O2.Pd/c1-3-61-47-43(53)39(49)37(40(50)44(47)54)35-29-19-15-25(57-29)33(23-11-7-5-8-12-23)27-17-21-31(59-27)36(38-41(51)45(55)48(62-4-2)46(56)42(38)52)32-22-18-28(60-32)34(24-13-9-6-10-14-24)26-16-20-30(35)58-26;/h5-22H,3-4H2,1-2H3;/q-2;+2