dimethyl 2-(5-chloranylpyrimidin-4-yl)propanedioate

Systemtic Name: dimethyl 2-(5-chloranylpyrimidin-4-yl)propanedioate Openeye Name: dimethyl 2-(5-chloropyrimidin-4-yl)propanedioate CAS Name: 2-(5-chloro-4-pyrimidinyl)propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(5-chloropyrimidin-4-yl)propanedioate Traditional Name: 2-(5-chloropyrimidin-4-yl)malonic acid dimethyl ester Formula: C9H9ClN2O4 MolecularWeight: 244.63176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=NC=NC=C1Cl)C(=O)OC

Isomeric SMILES

COC(=O)C(C1=NC=NC=C1Cl)C(=O)OC

InChI

InChI=1S/C9H9ClN2O4/c1-15-8(13)6(9(14)16-2)7-5(10)3-11-4-12-7/h3-4,6H,1-2H3