5,10,15,20-tetrakis(1-methylpyridin-1-ium-4-yl)-1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24-tetracosahydroporphyrin tetraiodide

Systemtic Name: 5,10,15,20-tetrakis(1-methylpyridin-1-ium-4-yl)-1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24-tetracosahydroporphyrin tetraiodide Openeye Name: 5,10,15,20-tetrakis(1-methylpyridin-1-ium-4-yl)-1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24-tetracosahydroporphyrin tetraiodide CAS Name: 5,10,15,20-tetrakis(1-methyl-4-pyridin-1-iumyl)-1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24-tetracosahydroporphyrin tetraiodide IUPAC Name: 5,10,15,20-tetrakis(1-methylpyridin-1-ium-4-yl)-1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24-tetracosahydroporphyrin tetraiodide Traditional Name: 5,10,15,20-tetrakis(1-methylpyridin-1-ium-4-yl)-1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24-tetracosahydroporphine tetraiodide Formula: C44H60I4N8 MolecularWeight: 1208.61868

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=C(C=C1)C2C3CCC(N3)C(C4CCC(N4)C(C5CCC(N5)C(C6CCC2N6)C7=CC=[N+](C=C7)C)C8=CC=[N+](C=C8)C)C9=CC=[N+](C=C9)C.[I-].[I-].[I-].[I-]

Isomeric SMILES

C[N+]1=CC=C(C=C1)C2C3CCC(N3)C(C4CCC(N4)C(C5CCC(N5)C(C6CCC2N6)C7=CC=[N+](C=C7)C)C8=CC=[N+](C=C8)C)C9=CC=[N+](C=C9)C.[I-].[I-].[I-].[I-]

InChI

InChI=1S/C44H60N8.4HI/c1-49-21-13-29(14-22-49)41-33-5-7-35(45-33)42(30-15-23-50(2)24-16-30)37-9-11-39(47-37)44(32-19-27-52(4)28-20-32)40-12-10-38(48-40)43(36-8-6-34(41)46-36)31-17-25-51(3)26-18-31;;;;/h13-28,33-48H,5-12H2,1-4H3;4*1H/q+4;;;;/p-4