methyl 3-(2-chloranylpyrimidin-4-yl)-3-(3-cyanophenyl)propanoate

Systemtic Name: methyl 3-(2-chloranylpyrimidin-4-yl)-3-(3-cyanophenyl)propanoate Openeye Name: methyl 3-(2-chloropyrimidin-4-yl)-3-(3-cyanophenyl)propanoate CAS Name: 3-(2-chloro-4-pyrimidinyl)-3-(3-cyanophenyl)propanoic acid methyl ester IUPAC Name: methyl 3-(2-chloropyrimidin-4-yl)-3-(3-cyanophenyl)propanoate Traditional Name: 3-(2-chloropyrimidin-4-yl)-3-(3-cyanophenyl)propionic acid methyl ester Formula: C15H12ClN3O2 MolecularWeight: 301.72768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=NC(=NC=C1)Cl)C2=CC=CC(=C2)C#N

Isomeric SMILES

COC(=O)CC(C1=NC(=NC=C1)Cl)C2=CC=CC(=C2)C#N

InChI

InChI=1S/C15H12ClN3O2/c1-21-14(20)8-12(13-5-6-18-15(16)19-13)11-4-2-3-10(7-11)9-17/h2-7,12H,8H2,1H3