ethyl (2S,5E)-5-[2,6-bis(oxidanylidene)pyrimidin-5-ylidene]pyrrolidine-2-carboxylate

Systemtic Name: ethyl (2S,5E)-5-[2,6-bis(oxidanylidene)pyrimidin-5-ylidene]pyrrolidine-2-carboxylate Openeye Name: ethyl (2S,5E)-5-(2,6-dioxopyrimidin-5-ylidene)pyrrolidine-2-carboxylate CAS Name: (2S,5E)-5-(2,6-dioxo-5-pyrimidinylidene)-2-pyrrolidinecarboxylic acid ethyl ester IUPAC Name: ethyl (2S,5E)-5-(2,6-dioxopyrimidin-5-ylidene)pyrrolidine-2-carboxylate Traditional Name: (2S,5E)-5-(2,6-diketopyrimidin-5-ylidene)pyrrolidine-2-carboxylic acid ethyl ester Formula: C11H13N3O4 MolecularWeight: 251.23862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC(=C2C=NC(=O)NC2=O)N1

Isomeric SMILES

CCOC(=O)[C@@H]1CC/C(=C\2/C=NC(=O)NC2=O)/N1

InChI

InChI=1S/C11H13N3O4/c1-2-18-10(16)8-4-3-7(13-8)6-5-12-11(17)14-9(6)15/h5,8,13H,2-4H2,1H3,(H,14,15,17)/b7-6+/t8-/m0/s1