2-[1,7-dimethyl-2,6-bis(oxidanylidene)purin-3-yl]ethanoate

Systemtic Name: 2-[1,7-dimethyl-2,6-bis(oxidanylidene)purin-3-yl]ethanoate Openeye Name: 2-(1,7-dimethyl-2,6-dioxo-purin-3-yl)acetate CAS Name: 2-(1,7-dimethyl-2,6-dioxo-3-purinyl)acetate IUPAC Name: 2-(1,7-dimethyl-2,6-dioxopurin-3-yl)acetate Traditional Name: 2-(2,6-diketo-1,7-dimethyl-purin-3-yl)acetate Formula: C9H9N4O4- MolecularWeight: 237.19216

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2CC(=O)[O-])C

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2CC(=O)[O-])C

InChI

InChI=1S/C9H10N4O4/c1-11-4-10-7-6(11)8(16)12(2)9(17)13(7)3-5(14)15/h4H,3H2,1-2H3,(H,14,15)/p-1