ethyl 4-(5-butylpyrimidin-2-yl)benzoate

Systemtic Name: ethyl 4-(5-butylpyrimidin-2-yl)benzoate Openeye Name: ethyl 4-(5-butylpyrimidin-2-yl)benzoate CAS Name: 4-(5-butyl-2-pyrimidinyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-(5-butylpyrimidin-2-yl)benzoate Traditional Name: 4-(5-butylpyrimidin-2-yl)benzoic acid ethyl ester Formula: C17H20N2O2 MolecularWeight: 284.3529

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OCC

Isomeric SMILES

CCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OCC

InChI

InChI=1S/C17H20N2O2/c1-3-5-6-13-11-18-16(19-12-13)14-7-9-15(10-8-14)17(20)21-4-2/h7-12H,3-6H2,1-2H3