2-(4-decylphenyl)-5-(2-fluoranyl-3-methyl-pentoxy)pyrimidine

Systemtic Name: 2-(4-decylphenyl)-5-(2-fluoranyl-3-methyl-pentoxy)pyrimidine Openeye Name: 2-(4-decylphenyl)-5-(2-fluoro-3-methyl-pentoxy)pyrimidine CAS Name: 2-(4-decylphenyl)-5-(2-fluoro-3-methylpentoxy)pyrimidine IUPAC Name: 2-(4-decylphenyl)-5-(2-fluoro-3-methylpentoxy)pyrimidine Traditional Name: 2-(4-decylphenyl)-5-(2-fluoro-3-methyl-pentoxy)pyrimidine Formula: C26H39FN2O MolecularWeight: 414.599063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCC(C(C)CC)F

Isomeric SMILES

CCCCCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)OCC(C(C)CC)F

InChI

InChI=1S/C26H39FN2O/c1-4-6-7-8-9-10-11-12-13-22-14-16-23(17-15-22)26-28-18-24(19-29-26)30-20-25(27)21(3)5-2/h14-19,21,25H,4-13,20H2,1-3H3