5-heptyl-2-[4-[[4-(trifluoromethyl)phenyl]methoxy]phenyl]pyrimidine

Systemtic Name: 5-heptyl-2-[4-[[4-(trifluoromethyl)phenyl]methoxy]phenyl]pyrimidine Openeye Name: 5-heptyl-2-[4-[[4-(trifluoromethyl)phenyl]methoxy]phenyl]pyrimidine CAS Name: 5-heptyl-2-[4-[[4-(trifluoromethyl)phenyl]methoxy]phenyl]pyrimidine IUPAC Name: 5-heptyl-2-[4-[[4-(trifluoromethyl)phenyl]methoxy]phenyl]pyrimidine Traditional Name: 5-heptyl-2-[4-[4-(trifluoromethyl)benzyl]oxyphenyl]pyrimidine Formula: C25H27F3N2O MolecularWeight: 428.48989

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C25H27F3N2O/c1-2-3-4-5-6-7-20-16-29-24(30-17-20)21-10-14-23(15-11-21)31-18-19-8-12-22(13-9-19)25(26,27)28/h8-17H,2-7,18H2,1H3