4-(5-tridecylpyrimidin-2-yl)benzoic acid

Systemtic Name: 4-(5-tridecylpyrimidin-2-yl)benzoic acid Openeye Name: 4-(5-tridecylpyrimidin-2-yl)benzoic acid CAS Name: 4-(5-tridecyl-2-pyrimidinyl)benzoic acid IUPAC Name: 4-(5-tridecylpyrimidin-2-yl)benzoic acid Traditional Name: 4-(5-tridecylpyrimidin-2-yl)benzoic acid Formula: C24H34N2O2 MolecularWeight: 382.53896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C24H34N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-20-18-25-23(26-19-20)21-14-16-22(17-15-21)24(27)28/h14-19H,2-13H2,1H3,(H,27,28)