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

Systemtic Name: 6-(1,3-benzodioxol-5-yl)-2,4-dimethyl-8H-purino[7,8-a]imidazole-1,3,7-trione Openeye Name: 6-(1,3-benzodioxol-5-yl)-2,4-dimethyl-8H-purino[7,8-a]imidazole-1,3,7-trione CAS Name: 6-(1,3-benzodioxol-5-yl)-2,4-dimethyl-8H-purino[7,8-a]imidazole-1,3,7-trione IUPAC Name: 6-(1,3-benzodioxol-5-yl)-2,4-dimethyl-8H-purino[7,8-a]imidazole-1,3,7-trione Traditional Name: 6-(1,3-benzodioxol-5-yl)-2,4-dimethyl-8H-purin[7,8-a]imidazole-1,3,7-trione Formula: C16H13N5O5 MolecularWeight: 355.30492

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N3CC(=O)N(C3=N2)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N3CC(=O)N(C3=N2)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C16H13N5O5/c1-18-13-12(14(23)19(2)16(18)24)20-6-11(22)21(15(20)17-13)8-3-4-9-10(5-8)26-7-25-9/h3-5H,6-7H2,1-2H3