6-(4-ethoxyphenyl)-2,4-dimethyl-7-(4-nitrophenyl)purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6-(4-ethoxyphenyl)-2,4-dimethyl-7-(4-nitrophenyl)purino[7,8-a]imidazole-1,3-dione Openeye Name: 6-(4-ethoxyphenyl)-2,4-dimethyl-7-(4-nitrophenyl)purino[7,8-a]imidazole-1,3-dione CAS Name: 6-(4-ethoxyphenyl)-2,4-dimethyl-7-(4-nitrophenyl)purino[7,8-a]imidazole-1,3-dione IUPAC Name: 6-(4-ethoxyphenyl)-2,4-dimethyl-7-(4-nitrophenyl)purino[7,8-a]imidazole-1,3-dione Traditional Name: 2,4-dimethyl-7-(4-nitrophenyl)-6-p-phenetyl-purin[7,8-a]imidazole-1,3-quinone Formula: C23H20N6O5 MolecularWeight: 460.4421

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)C)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=CN3C2=NC4=C3C(=O)N(C(=O)N4C)C)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H20N6O5/c1-4-34-17-11-9-15(10-12-17)28-18(14-5-7-16(8-6-14)29(32)33)13-27-19-20(24-22(27)28)25(2)23(31)26(3)21(19)30/h5-13H,4H2,1-3H3