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

Systemtic Name: 2-[3-methyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoate Openeye Name: 2-(3-methyl-2,6-dioxo-purin-7-yl)acetate CAS Name: 2-(3-methyl-2,6-dioxo-7-purinyl)acetate IUPAC Name: 2-(3-methyl-2,6-dioxopurin-7-yl)acetate Traditional Name: 2-(2,6-diketo-3-methyl-purin-7-yl)acetate Formula: C8H7N4O4- MolecularWeight: 223.16558

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C=N2)CC(=O)[O-]

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C=N2)CC(=O)[O-]

InChI

InChI=1S/C8H8N4O4/c1-11-6-5(7(15)10-8(11)16)12(3-9-6)2-4(13)14/h3H,2H2,1H3,(H,13,14)(H,10,15,16)/p-1