copper; 5,10,15,20-tetrakis[2,3,4,5,6-pentakis(fluoranyl)cyclohexyl]-1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20-icosahydroporphyrin-21,22,23,24-tetraide

Systemtic Name: copper; 5,10,15,20-tetrakis[2,3,4,5,6-pentakis(fluoranyl)cyclohexyl]-1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20-icosahydroporphyrin-21,22,23,24-tetraide Openeye Name: copper; 5,10,15,20-tetrakis(2,3,4,5,6-pentafluorocyclohexyl)-1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20-icosahydroporphyrin-21,22,23,24-tetraide CAS Name: copper; 5,10,15,20-tetrakis(2,3,4,5,6-pentafluorocyclohexyl)-1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20-eicosahydroporphyrin-21,22,23,24-tetraide IUPAC Name: copper; 5,10,15,20-tetrakis(2,3,4,5,6-pentafluorocyclohexyl)-1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20-icosahydroporphyrin-21,22,23,24-tetraide Traditional Name: copper; 5,10,15,20-tetrakis(2,3,4,5,6-pentafluorocyclohexyl)-1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20-eicosahydroporphine-21,22,23,24-tetraide Formula: C44H52CuF20N4-4 MolecularWeight: 1080.424544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(C3CCC([N-]3)C(C4CCC([N-]4)C(C5CCC([N-]5)C(C1[N-]2)C6C(C(C(C(C6F)F)F)F)F)C7C(C(C(C(C7F)F)F)F)F)C8C(C(C(C(C8F)F)F)F)F)C9C(C(C(C(C9F)F)F)F)F.[Cu]

Isomeric SMILES

C1CC2C(C3CCC([N-]3)C(C4CCC([N-]4)C(C5CCC([N-]5)C(C1[N-]2)C6C(C(C(C(C6F)F)F)F)F)C7C(C(C(C(C7F)F)F)F)F)C8C(C(C(C(C8F)F)F)F)F)C9C(C(C(C(C9F)F)F)F)F.[Cu]

InChI

InChI=1S/C44H52F20N4.Cu/c45-25-21(26(46)34(54)41(61)33(25)53)17-9-1-2-10(65-9)18(22-27(47)35(55)42(62)36(56)28(22)48)12-5-6-14(67-12)20(24-31(51)39(59)44(64)40(60)32(24)52)16-8-7-15(68-16)19(13-4-3-11(17)66-13)23-29(49)37(57)43(63)38(58)30(23)50;/h9-44H,1-8H2;/q-4;