[5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-2-cyano-3-oxidanyl-oxolan-2-yl]methyl ethanoate

Systemtic Name: [5-[2,4-bis(oxidanylidene)pyrimidin-1-yl]-2-cyano-3-oxidanyl-oxolan-2-yl]methyl ethanoate Openeye Name: [2-cyano-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl acetate CAS Name: acetic acid [2-cyano-5-(2,4-dioxo-1-pyrimidinyl)-3-hydroxy-2-oxolanyl]methyl ester IUPAC Name: [2-cyano-5-(2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl acetate Traditional Name: acetic acid [2-cyano-5-(2,4-diketopyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl ester Formula: C12H13N3O6 MolecularWeight: 295.24812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC1(C(CC(O1)N2C=CC(=O)NC2=O)O)C#N

Isomeric SMILES

CC(=O)OCC1(C(CC(O1)N2C=CC(=O)NC2=O)O)C#N

InChI

InChI=1S/C12H13N3O6/c1-7(16)20-6-12(5-13)8(17)4-10(21-12)15-3-2-9(18)14-11(15)19/h2-3,8,10,17H,4,6H2,1H3,(H,14,18,19)