diethyl 2-[1,3,7-trimethyl-2,6-bis(oxidanylidene)purin-8-yl]propanedioate

Systemtic Name: diethyl 2-[1,3,7-trimethyl-2,6-bis(oxidanylidene)purin-8-yl]propanedioate Openeye Name: diethyl 2-(1,3,7-trimethyl-2,6-dioxo-purin-8-yl)propanedioate CAS Name: 2-(1,3,7-trimethyl-2,6-dioxo-8-purinyl)propanedioic acid diethyl ester IUPAC Name: diethyl 2-(1,3,7-trimethyl-2,6-dioxopurin-8-yl)propanedioate Traditional Name: 2-(2,6-diketo-1,3,7-trimethyl-purin-8-yl)malonic acid diethyl ester Formula: C15H20N4O6 MolecularWeight: 352.3425

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=NC2=C(N1C)C(=O)N(C(=O)N2C)C)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C1=NC2=C(N1C)C(=O)N(C(=O)N2C)C)C(=O)OCC

InChI

InChI=1S/C15H20N4O6/c1-6-24-13(21)8(14(22)25-7-2)10-16-11-9(17(10)3)12(20)19(5)15(23)18(11)4/h8H,6-7H2,1-5H3