4-[2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethoxy]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethoxy]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)ethoxy]-4-oxo-butanoic acid CAS Name: 4-[2-(1,3-dimethyl-2,6-dioxo-7-purinyl)ethoxy]-4-oxobutanoic acid IUPAC Name: 4-[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethoxy]-4-oxobutanoic acid Traditional Name: 4-[2-(2,6-diketo-1,3-dimethyl-purin-7-yl)ethoxy]-4-keto-butyric acid Formula: C13H16N4O6 MolecularWeight: 324.28934

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCOC(=O)CCC(=O)O

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCOC(=O)CCC(=O)O

InChI

InChI=1S/C13H16N4O6/c1-15-11-10(12(21)16(2)13(15)22)17(7-14-11)5-6-23-9(20)4-3-8(18)19/h7H,3-6H2,1-2H3,(H,18,19)