2-(4-bromophenyl)-2-(4H-pyrimidin-3-yl)ethanoic acid

Systemtic Name: 2-(4-bromophenyl)-2-(4H-pyrimidin-3-yl)ethanoic acid Openeye Name: 2-(4-bromophenyl)-2-(4H-pyrimidin-3-yl)acetic acid CAS Name: 2-(4-bromophenyl)-2-(4H-pyrimidin-3-yl)acetic acid IUPAC Name: 2-(4-bromophenyl)-2-(4H-pyrimidin-3-yl)acetic acid Traditional Name: 2-(4-bromophenyl)-2-(4H-pyrimidin-3-yl)acetic acid Formula: C12H11BrN2O2 MolecularWeight: 295.13194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=CN=CN1C(C2=CC=C(C=C2)Br)C(=O)O

Isomeric SMILES

C1C=CN=CN1C(C2=CC=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C12H11BrN2O2/c13-10-4-2-9(3-5-10)11(12(16)17)15-7-1-6-14-8-15/h1-6,8,11H,7H2,(H,16,17)