methyl 2-[2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoyloxy]propanoate

Systemtic Name: methyl 2-[2-[1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]ethanoyloxy]propanoate Openeye Name: methyl 2-[2-(1,3-dimethyl-2,6-dioxo-purin-7-yl)acetyl]oxypropanoate CAS Name: 2-[2-(1,3-dimethyl-2,6-dioxo-7-purinyl)-1-oxoethoxy]propanoic acid methyl ester IUPAC Name: methyl 2-[2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetyl]oxypropanoate Traditional Name: 2-[2-(2,6-diketo-1,3-dimethyl-purin-7-yl)acetyl]oxypropionic acid methyl ester Formula: C13H16N4O6 MolecularWeight: 324.28934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)OC(=O)CN1C=NC2=C1C(=O)N(C(=O)N2C)C

Isomeric SMILES

CC(C(=O)OC)OC(=O)CN1C=NC2=C1C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C13H16N4O6/c1-7(12(20)22-4)23-8(18)5-17-6-14-10-9(17)11(19)16(3)13(21)15(10)2/h6-7H,5H2,1-4H3