ethyl 4-(2-chloranylpyrimidin-4-yl)benzoate

Systemtic Name: ethyl 4-(2-chloranylpyrimidin-4-yl)benzoate Openeye Name: ethyl 4-(2-chloropyrimidin-4-yl)benzoate CAS Name: 4-(2-chloro-4-pyrimidinyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(2-chloropyrimidin-4-yl)benzoate Traditional Name: 4-(2-chloropyrimidin-4-yl)benzoic acid ethyl ester Formula: C13H11ClN2O2 MolecularWeight: 262.69164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)C2=NC(=NC=C2)Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)C2=NC(=NC=C2)Cl

InChI

InChI=1S/C13H11ClN2O2/c1-2-18-12(17)10-5-3-9(4-6-10)11-7-8-15-13(14)16-11/h3-8H,2H2,1H3