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

Systemtic Name: 2-[1-methyl-2,6-bis(oxidanylidene)-7H-purin-3-yl]butanoic acid Openeye Name: 2-(1-methyl-2,6-dioxo-7H-purin-3-yl)butanoic acid CAS Name: 2-(1-methyl-2,6-dioxo-7H-purin-3-yl)butanoic acid IUPAC Name: 2-(1-methyl-2,6-dioxo-7H-purin-3-yl)butanoic acid Traditional Name: 2-(2,6-diketo-1-methyl-7H-purin-3-yl)butyric acid Formula: C10H12N4O4 MolecularWeight: 252.22668

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)N1C2=C(C(=O)N(C1=O)C)NC=N2

Isomeric SMILES

CCC(C(=O)O)N1C2=C(C(=O)N(C1=O)C)NC=N2

InChI

InChI=1S/C10H12N4O4/c1-3-5(9(16)17)14-7-6(11-4-12-7)8(15)13(2)10(14)18/h4-5H,3H2,1-2H3,(H,11,12)(H,16,17)