2-(3-fluoranyl-4-octoxy-phenyl)-5-pentyl-pyrimidine

Systemtic Name: 2-(3-fluoranyl-4-octoxy-phenyl)-5-pentyl-pyrimidine Openeye Name: 2-(3-fluoro-4-octoxy-phenyl)-5-pentyl-pyrimidine CAS Name: 2-(3-fluoro-4-octoxyphenyl)-5-pentylpyrimidine IUPAC Name: 2-(3-fluoro-4-octoxyphenyl)-5-pentylpyrimidine Traditional Name: 5-amyl-2-(3-fluoro-4-octoxy-phenyl)pyrimidine Formula: C23H33FN2O MolecularWeight: 372.519323

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=C(C=C1)C2=NC=C(C=N2)CCCCC)F

Isomeric SMILES

CCCCCCCCOC1=C(C=C(C=C1)C2=NC=C(C=N2)CCCCC)F

InChI

InChI=1S/C23H33FN2O/c1-3-5-7-8-9-11-15-27-22-14-13-20(16-21(22)24)23-25-17-19(18-26-23)12-10-6-4-2/h13-14,16-18H,3-12,15H2,1-2H3