ethyl 3-methyl-4-oxidanylidene-5-(2-oxidanylidenepropyl)-[1,2]oxazolo[5,4-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 3-methyl-4-oxidanylidene-5-(2-oxidanylidenepropyl)-[1,2]oxazolo[5,4-d]pyrimidine-6-carboxylate Openeye Name: ethyl 5-acetonyl-3-methyl-4-oxo-isoxazolo[5,4-d]pyrimidine-6-carboxylate CAS Name: 3-methyl-4-oxo-5-(2-oxopropyl)-6-isoxazolo[5,4-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-4-oxo-5-(2-oxopropyl)-[1,2]oxazolo[5,4-d]pyrimidine-6-carboxylate Traditional Name: 5-acetonyl-4-keto-3-methyl-isoxazolo[5,4-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C12H13N3O5 MolecularWeight: 279.24872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC2=C(C(=NO2)C)C(=O)N1CC(=O)C

Isomeric SMILES

CCOC(=O)C1=NC2=C(C(=NO2)C)C(=O)N1CC(=O)C

InChI

InChI=1S/C12H13N3O5/c1-4-19-12(18)9-13-10-8(7(3)14-20-10)11(17)15(9)5-6(2)16/h4-5H2,1-3H3