4-methyl-7-(3-nitrophenyl)-6-phenyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 4-methyl-7-(3-nitrophenyl)-6-phenyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 4-methyl-7-(3-nitrophenyl)-6-phenyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 4-methyl-7-(3-nitrophenyl)-6-phenylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 4-methyl-7-(3-nitrophenyl)-6-phenylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 4-methyl-7-(3-nitrophenyl)-6-phenyl-purin[7,8-a]imidazole-1,3-quinone Formula: C20H14N6O4 MolecularWeight: 402.36296

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N3C=C(N(C3=N2)C4=CC=CC=C4)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N3C=C(N(C3=N2)C4=CC=CC=C4)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C20H14N6O4/c1-23-17-16(18(27)22-20(23)28)24-11-15(12-6-5-9-14(10-12)26(29)30)25(19(24)21-17)13-7-3-2-4-8-13/h2-11H,1H3,(H,22,27,28)