[4-(5-octoxypyrimidin-2-yl)phenyl] 4-cyclohexylbenzoate

Systemtic Name: [4-(5-octoxypyrimidin-2-yl)phenyl] 4-cyclohexylbenzoate Openeye Name: [4-(5-octoxypyrimidin-2-yl)phenyl] 4-cyclohexylbenzoate CAS Name: 4-cyclohexylbenzoic acid [4-(5-octoxy-2-pyrimidinyl)phenyl] ester IUPAC Name: [4-(5-octoxypyrimidin-2-yl)phenyl] 4-cyclohexylbenzoate Traditional Name: 4-cyclohexylbenzoic acid [4-(5-octoxypyrimidin-2-yl)phenyl] ester Formula: C31H38N2O3 MolecularWeight: 486.64502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C4CCCCC4

Isomeric SMILES

CCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)C4CCCCC4

InChI

InChI=1S/C31H38N2O3/c1-2-3-4-5-6-10-21-35-29-22-32-30(33-23-29)26-17-19-28(20-18-26)36-31(34)27-15-13-25(14-16-27)24-11-8-7-9-12-24/h13-20,22-24H,2-12,21H2,1H3