1,1,2,2-tetrakis(fluoranyl)-2-[1,1,2,2-tetrakis(fluoranyl)-2-[5,10,15,20-tetrakis[4-(trifluoromethyl)phenyl]-21,22-dihydroporphyrin-2-yl]ethoxy]ethanesulfonyl fluoride

Systemtic Name: 1,1,2,2-tetrakis(fluoranyl)-2-[1,1,2,2-tetrakis(fluoranyl)-2-[5,10,15,20-tetrakis[4-(trifluoromethyl)phenyl]-21,22-dihydroporphyrin-2-yl]ethoxy]ethanesulfonyl fluoride Openeye Name: 1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-[5,10,15,20-tetrakis[4-(trifluoromethyl)phenyl]-21,22-dihydroporphyrin-2-yl]ethoxy]ethanesulfonyl fluoride CAS Name: 1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-[5,10,15,20-tetrakis[4-(trifluoromethyl)phenyl]-21,22-dihydroporphyrin-2-yl]ethoxy]ethanesulfonyl fluoride IUPAC Name: 1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-[5,10,15,20-tetrakis[4-(trifluoromethyl)phenyl]-21,22-dihydroporphyrin-2-yl]ethoxy]ethanesulfonyl fluoride Traditional Name: 1,1,2,2-tetrafluoro-2-[1,1,2,2-tetrafluoro-2-[5,10,15,20-tetrakis[4-(trifluoromethyl)phenyl]-21,22-dihydroporphin-2-yl]ethoxy]ethanesulfonyl fluoride Formula: C52H25F21N4O3S MolecularWeight: 1184.811367

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C3C=CC(=C(C4=CC(=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)C(F)(F)F)C8=CC=C(C=C8)C(F)(F)F)C(C(OC(C(F)(F)S(=O)(=O)F)(F)F)(F)F)(F)F)C9=CC=C(C=C9)C(F)(F)F)N3)C(F)(F)F

Isomeric SMILES

C1=CC(=CC=C1C2=C3C=CC(=C(C4=CC(=C(N4)C(=C5C=CC(=N5)C(=C6C=CC2=N6)C7=CC=C(C=C7)C(F)(F)F)C8=CC=C(C=C8)C(F)(F)F)C(C(OC(C(F)(F)S(=O)(=O)F)(F)F)(F)F)(F)F)C9=CC=C(C=C9)C(F)(F)F)N3)C(F)(F)F

InChI

InChI=1S/C52H25F21N4O3S/c53-45(54,50(67,68)80-51(69,70)52(71,72)81(73,78)79)32-23-39-42(26-5-13-30(14-6-26)48(61,62)63)37-20-19-35(75-37)40(24-1-9-28(10-2-24)46(55,56)57)33-17-18-34(74-33)41(25-3-11-29(12-4-25)47(58,59)60)36-21-22-38(76-36)43(44(32)77-39)27-7-15-31(16-8-27)49(64,65)66/h1-23,75,77H