6,7-bis(1,3-benzodioxol-5-yl)-2,4-dimethyl-purino[7,8-a]imidazole-1,3-dione

Systemtic Name: 6,7-bis(1,3-benzodioxol-5-yl)-2,4-dimethyl-purino[7,8-a]imidazole-1,3-dione Openeye Name: 6,7-bis(1,3-benzodioxol-5-yl)-2,4-dimethyl-purino[7,8-a]imidazole-1,3-dione CAS Name: 6,7-bis(1,3-benzodioxol-5-yl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione IUPAC Name: 6,7-bis(1,3-benzodioxol-5-yl)-2,4-dimethylpurino[7,8-a]imidazole-1,3-dione Traditional Name: 6,7-bis(1,3-benzodioxol-5-yl)-2,4-dimethyl-purin[7,8-a]imidazole-1,3-quinone Formula: C23H17N5O6 MolecularWeight: 459.41098

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)C4=CC5=C(C=C4)OCO5)C6=CC7=C(C=C6)OCO7

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N3C=C(N(C3=N2)C4=CC5=C(C=C4)OCO5)C6=CC7=C(C=C6)OCO7

InChI

InChI=1S/C23H17N5O6/c1-25-20-19(21(29)26(2)23(25)30)27-9-14(12-3-5-15-17(7-12)33-10-31-15)28(22(27)24-20)13-4-6-16-18(8-13)34-11-32-16/h3-9H,10-11H2,1-2H3