2-[4-[2,5-bis(fluoranyl)-3,6-bis[1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecakis(fluoranyl)octyl]-4-[4-(1H-phenanthro[9,10-d]imidazol-2-yl)phenyl]phenyl]phenyl]-1H-phenanthro[9,10-d]imidazole

Systemtic Name: 2-[4-[2,5-bis(fluoranyl)-3,6-bis[1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecakis(fluoranyl)octyl]-4-[4-(1H-phenanthro[9,10-d]imidazol-2-yl)phenyl]phenyl]phenyl]-1H-phenanthro[9,10-d]imidazole Openeye Name: 2-[4-[2,5-difluoro-3,6-bis(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-4-[4-(1H-phenanthro[9,10-d]imidazol-2-yl)phenyl]phenyl]phenyl]-1H-phenanthro[9,10-d]imidazole CAS Name: 2-[4-[2,5-difluoro-3,6-bis(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-4-[4-(1H-phenanthro[9,10-d]imidazol-2-yl)phenyl]phenyl]phenyl]-1H-phenanthro[9,10-d]imidazole IUPAC Name: 2-[4-[2,5-difluoro-3,6-bis(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-4-[4-(1H-phenanthro[9,10-d]imidazol-2-yl)phenyl]phenyl]phenyl]-1H-phenanthro[9,10-d]imidazole Traditional Name: 2-[4-[2,5-difluoro-3,6-bis(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-4-[4-(1H-phenanthr[9,10-d]imidazol-2-yl)phenyl]phenyl]phenyl]-1H-phenanthr[9,10-d]imidazole Formula: C64H26F36N4 MolecularWeight: 1534.860555

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=CC=CC=C3C4=C2NC(=N4)C5=CC=C(C=C5)C6=C(C(=C(C(=C6F)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C7=CC=C(C=C7)C8=NC9=C(N8)C1=CC=CC=C1C1=CC=CC=C19)F)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C3=CC=CC=C3C4=C2NC(=N4)C5=CC=C(C=C5)C6=C(C(=C(C(=C6F)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)C7=CC=C(C=C7)C8=NC9=C(N8)C1=CC=CC=C1C1=CC=CC=C19)F)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

InChI

InChI=1S/C64H26F36N4/c65-41-37(25-17-21-27(22-18-25)47-101-43-33-13-5-1-9-29(33)30-10-2-6-14-34(30)44(43)102-47)39(49(67,68)51(71,72)53(75,76)55(79,80)57(83,84)59(87,88)61(91,92)63(95,96)97)42(66)38(40(41)50(69,70)52(73,74)54(77,78)56(81,82)58(85,86)60(89,90)62(93,94)64(98,99)100)26-19-23-28(24-20-26)48-103-45-35-15-7-3-11-31(35)32-12-4-8-16-36(32)46(45)104-48/h1-24H,(H,101,102)(H,103,104)