methyl 8-cyclobutyl-1,3-dimethyl-2,6-bis(oxidanylidene)purine-7-carboxylate

Systemtic Name: methyl 8-cyclobutyl-1,3-dimethyl-2,6-bis(oxidanylidene)purine-7-carboxylate Openeye Name: methyl 8-cyclobutyl-1,3-dimethyl-2,6-dioxo-purine-7-carboxylate CAS Name: 8-cyclobutyl-1,3-dimethyl-2,6-dioxo-7-purinecarboxylic acid methyl ester IUPAC Name: methyl 8-cyclobutyl-1,3-dimethyl-2,6-dioxopurine-7-carboxylate Traditional Name: 8-cyclobutyl-2,6-diketo-1,3-dimethyl-purine-7-carboxylic acid methyl ester Formula: C13H16N4O4 MolecularWeight: 292.29054

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)C3CCC3)C(=O)OC

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)C3CCC3)C(=O)OC

InChI

InChI=1S/C13H16N4O4/c1-15-10-8(11(18)16(2)12(15)19)17(13(20)21-3)9(14-10)7-5-4-6-7/h7H,4-6H2,1-3H3