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

Systemtic Name: [5-[5-ethynyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]-3-oxidanyl-oxolan-2-yl]methyl 2,2-dimethylpropanoate Openeye Name: [5-(5-ethynyl-2,4-dioxo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [5-(5-ethynyl-2,4-dioxo-1-pyrimidinyl)-3-hydroxy-2-oxolanyl]methyl ester IUPAC Name: [5-(5-ethynyl-2,4-dioxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [5-(5-ethynyl-2,4-diketo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl ester Formula: C16H20N2O6 MolecularWeight: 336.3398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCC1C(CC(O1)N2C=C(C(=O)NC2=O)C#C)O

Isomeric SMILES

CC(C)(C)C(=O)OCC1C(CC(O1)N2C=C(C(=O)NC2=O)C#C)O

InChI

InChI=1S/C16H20N2O6/c1-5-9-7-18(15(22)17-13(9)20)12-6-10(19)11(24-12)8-23-14(21)16(2,3)4/h1,7,10-12,19H,6,8H2,2-4H3,(H,17,20,22)