hexyl 4-(5-propylpyrimidin-2-yl)benzoate

Systemtic Name: hexyl 4-(5-propylpyrimidin-2-yl)benzoate Openeye Name: hexyl 4-(5-propylpyrimidin-2-yl)benzoate CAS Name: 4-(5-propyl-2-pyrimidinyl)benzoic acid hexyl ester IUPAC Name: hexyl 4-(5-propylpyrimidin-2-yl)benzoate Traditional Name: 4-(5-propylpyrimidin-2-yl)benzoic acid hexyl ester Formula: C20H26N2O2 MolecularWeight: 326.43264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=C(C=C1)C2=NC=C(C=N2)CCC

Isomeric SMILES

CCCCCCOC(=O)C1=CC=C(C=C1)C2=NC=C(C=N2)CCC

InChI

InChI=1S/C20H26N2O2/c1-3-5-6-7-13-24-20(23)18-11-9-17(10-12-18)19-21-14-16(8-4-2)15-22-19/h9-12,14-15H,3-8,13H2,1-2H3