2-[1-methyl-2,6-bis(oxidanylidene)-7H-purin-3-yl]ethanoic acid

Systemtic Name: 2-[1-methyl-2,6-bis(oxidanylidene)-7H-purin-3-yl]ethanoic acid Openeye Name: 2-(1-methyl-2,6-dioxo-7H-purin-3-yl)acetic acid CAS Name: 2-(1-methyl-2,6-dioxo-7H-purin-3-yl)acetic acid IUPAC Name: 2-(1-methyl-2,6-dioxo-7H-purin-3-yl)acetic acid Traditional Name: 2-(2,6-diketo-1-methyl-7H-purin-3-yl)acetic acid Formula: C8H8N4O4 MolecularWeight: 224.17352

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=CN2)N(C1=O)CC(=O)O

Isomeric SMILES

CN1C(=O)C2=C(N=CN2)N(C1=O)CC(=O)O

InChI

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