6-(2,4-dimethoxyphenyl)-2,4-dimethyl-7-phenyl-purino[7,8-a]imidazole-4,9-diium-1,3-dione

Systemtic Name: 6-(2,4-dimethoxyphenyl)-2,4-dimethyl-7-phenyl-purino[7,8-a]imidazole-4,9-diium-1,3-dione Openeye Name: 6-(2,4-dimethoxyphenyl)-2,4-dimethyl-7-phenyl-purino[7,8-a]imidazole-4,9-diium-1,3-dione CAS Name: 6-(2,4-dimethoxyphenyl)-2,4-dimethyl-7-phenylpurino[7,8-a]imidazole-4,9-diium-1,3-dione IUPAC Name: 6-(2,4-dimethoxyphenyl)-2,4-dimethyl-7-phenylpurino[7,8-a]imidazole-4,9-diium-1,3-dione Traditional Name: 6-(2,4-dimethoxyphenyl)-2,4-dimethyl-7-phenyl-purin[7,8-a]imidazole-4,9-diium-1,3-quinone Formula: C23H21N5O4+2 MolecularWeight: 431.44394

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=[N+]3C=C(N(C3=NC2=[N+](C1=O)C)C4=C(C=C(C=C4)OC)OC)C5=CC=CC=C5

Isomeric SMILES

CN1C(=O)C2=[N+]3C=C(N(C3=NC2=[N+](C1=O)C)C4=C(C=C(C=C4)OC)OC)C5=CC=CC=C5

InChI

InChI=1S/C23H21N5O4/c1-25-20-19(21(29)26(2)23(25)30)27-13-17(14-8-6-5-7-9-14)28(22(27)24-20)16-11-10-15(31-3)12-18(16)32-4/h5-13H,1-4H3/q+2