butyl 4-(5-hexylpyrimidin-2-yl)benzoate

Systemtic Name: butyl 4-(5-hexylpyrimidin-2-yl)benzoate Openeye Name: butyl 4-(5-hexylpyrimidin-2-yl)benzoate CAS Name: 4-(5-hexyl-2-pyrimidinyl)benzoic acid butyl ester IUPAC Name: butyl 4-(5-hexylpyrimidin-2-yl)benzoate Traditional Name: 4-(5-hexylpyrimidin-2-yl)benzoic acid butyl ester Formula: C21H28N2O2 MolecularWeight: 340.45922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OCCCC

Isomeric SMILES

CCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OCCCC

InChI

InChI=1S/C21H28N2O2/c1-3-5-7-8-9-17-15-22-20(23-16-17)18-10-12-19(13-11-18)21(24)25-14-6-4-2/h10-13,15-16H,3-9,14H2,1-2H3