2-[3-methyl-2,6,8-tris(oxidanylidene)-9H-purin-7-yl]ethanoic acid

Systemtic Name: 2-[3-methyl-2,6,8-tris(oxidanylidene)-9H-purin-7-yl]ethanoic acid Openeye Name: 2-(3-methyl-2,6,8-trioxo-9H-purin-7-yl)acetic acid CAS Name: 2-(3-methyl-2,6,8-trioxo-9H-purin-7-yl)acetic acid IUPAC Name: 2-(3-methyl-2,6,8-trioxo-9H-purin-7-yl)acetic acid Traditional Name: 2-(2,6,8-triketo-3-methyl-9H-purin-7-yl)acetic acid Formula: C8H8N4O5 MolecularWeight: 240.17292

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=O)N2)CC(=O)O

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=O)N2)CC(=O)O

InChI

InChI=1S/C8H8N4O5/c1-11-5-4(6(15)10-7(11)16)12(2-3(13)14)8(17)9-5/h2H2,1H3,(H,9,17)(H,13,14)(H,10,15,16)