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

Systemtic Name: (4-propylcyclohexyl) 4-(5-butylpyrimidin-2-yl)benzoate Openeye Name: (4-propylcyclohexyl) 4-(5-butylpyrimidin-2-yl)benzoate CAS Name: 4-(5-butyl-2-pyrimidinyl)benzoic acid (4-propylcyclohexyl) ester IUPAC Name: (4-propylcyclohexyl) 4-(5-butylpyrimidin-2-yl)benzoate Traditional Name: 4-(5-butylpyrimidin-2-yl)benzoic acid (4-propylcyclohexyl) ester Formula: C24H32N2O2 MolecularWeight: 380.52308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC3CCC(CC3)CCC

Isomeric SMILES

CCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(=O)OC3CCC(CC3)CCC

InChI

InChI=1S/C24H32N2O2/c1-3-5-7-19-16-25-23(26-17-19)20-10-12-21(13-11-20)24(27)28-22-14-8-18(6-4-2)9-15-22/h10-13,16-18,22H,3-9,14-15H2,1-2H3