2-[4,7-dimethyl-1,3-bis(oxidanylidene)purino[7,8-a]imidazol-6-yl]ethanoate

Systemtic Name: 2-[4,7-dimethyl-1,3-bis(oxidanylidene)purino[7,8-a]imidazol-6-yl]ethanoate Openeye Name: 2-(4,7-dimethyl-1,3-dioxo-purino[7,8-a]imidazol-6-yl)acetate CAS Name: 2-(4,7-dimethyl-1,3-dioxo-6-purino[7,8-a]imidazolyl)acetate IUPAC Name: 2-(4,7-dimethyl-1,3-dioxopurino[7,8-a]imidazol-6-yl)acetate Traditional Name: 2-(1,3-diketo-4,7-dimethyl-purin[7,8-a]imidazol-6-yl)acetate Formula: C11H10N5O4- MolecularWeight: 276.2282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C3=C(N=C2N1CC(=O)[O-])N(C(=O)NC3=O)C

Isomeric SMILES

CC1=CN2C3=C(N=C2N1CC(=O)[O-])N(C(=O)NC3=O)C

InChI

InChI=1S/C11H11N5O4/c1-5-3-16-7-8(14(2)11(20)13-9(7)19)12-10(16)15(5)4-6(17)18/h3H,4H2,1-2H3,(H,17,18)(H,13,19,20)/p-1