2-[4-[2-butoxy-3,3,3-tris(fluoranyl)propoxy]phenyl]-5-octyl-pyridine

Systemtic Name: 2-[4-[2-butoxy-3,3,3-tris(fluoranyl)propoxy]phenyl]-5-octyl-pyridine Openeye Name: 2-[4-(2-butoxy-3,3,3-trifluoro-propoxy)phenyl]-5-octyl-pyridine CAS Name: 2-[4-(2-butoxy-3,3,3-trifluoropropoxy)phenyl]-5-octylpyridine IUPAC Name: 2-[4-(2-butoxy-3,3,3-trifluoropropoxy)phenyl]-5-octylpyridine Traditional Name: 2-[4-(2-butoxy-3,3,3-trifluoro-propoxy)phenyl]-5-octyl-pyridine Formula: C26H36F3NO2 MolecularWeight: 451.56475

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)OCC(C(F)(F)F)OCCCC

Isomeric SMILES

CCCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)OCC(C(F)(F)F)OCCCC

InChI

InChI=1S/C26H36F3NO2/c1-3-5-7-8-9-10-11-21-12-17-24(30-19-21)22-13-15-23(16-14-22)32-20-25(26(27,28)29)31-18-6-4-2/h12-17,19,25H,3-11,18,20H2,1-2H3