4-[2-(4-methylphenyl)pyrimidin-4-yl]benzoic acid

Systemtic Name: 4-[2-(4-methylphenyl)pyrimidin-4-yl]benzoic acid Openeye Name: 4-[2-(p-tolyl)pyrimidin-4-yl]benzoic acid CAS Name: 4-[2-(4-methylphenyl)-4-pyrimidinyl]benzoic acid IUPAC Name: 4-[2-(4-methylphenyl)pyrimidin-4-yl]benzoic acid Traditional Name: 4-[2-(p-tolyl)pyrimidin-4-yl]benzoic acid Formula: C18H14N2O2 MolecularWeight: 290.31596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC=CC(=N2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC=CC(=N2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C18H14N2O2/c1-12-2-4-14(5-3-12)17-19-11-10-16(20-17)13-6-8-15(9-7-13)18(21)22/h2-11H,1H3,(H,21,22)