5-[4-[2-butoxy-3,3,3-tris(fluoranyl)propoxy]phenyl]-2-nonoxy-pyrimidine

Systemtic Name: 5-[4-[2-butoxy-3,3,3-tris(fluoranyl)propoxy]phenyl]-2-nonoxy-pyrimidine Openeye Name: 5-[4-(2-butoxy-3,3,3-trifluoro-propoxy)phenyl]-2-nonoxy-pyrimidine CAS Name: 5-[4-(2-butoxy-3,3,3-trifluoropropoxy)phenyl]-2-nonoxypyrimidine IUPAC Name: 5-[4-(2-butoxy-3,3,3-trifluoropropoxy)phenyl]-2-nonoxypyrimidine Traditional Name: 5-[4-(2-butoxy-3,3,3-trifluoro-propoxy)phenyl]-2-nonoxy-pyrimidine Formula: C26H37F3N2O3 MolecularWeight: 482.57879

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=NC=C(C=N1)C2=CC=C(C=C2)OCC(C(F)(F)F)OCCCC

Isomeric SMILES

CCCCCCCCCOC1=NC=C(C=N1)C2=CC=C(C=C2)OCC(C(F)(F)F)OCCCC

InChI

InChI=1S/C26H37F3N2O3/c1-3-5-7-8-9-10-11-17-33-25-30-18-22(19-31-25)21-12-14-23(15-13-21)34-20-24(26(27,28)29)32-16-6-4-2/h12-15,18-19,24H,3-11,16-17,20H2,1-2H3