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

Systemtic Name: 2-(3-fluoranyl-4-hexoxy-phenyl)-5-pentyl-pyrimidine Openeye Name: 2-(3-fluoro-4-hexoxy-phenyl)-5-pentyl-pyrimidine CAS Name: 2-(3-fluoro-4-hexoxyphenyl)-5-pentylpyrimidine IUPAC Name: 2-(3-fluoro-4-hexoxyphenyl)-5-pentylpyrimidine Traditional Name: 5-amyl-2-(3-fluoro-4-hexoxy-phenyl)pyrimidine Formula: C21H29FN2O MolecularWeight: 344.466163

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C2=NC=C(C=N2)CCCCC)F

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C2=NC=C(C=N2)CCCCC)F

InChI

InChI=1S/C21H29FN2O/c1-3-5-7-9-13-25-20-12-11-18(14-19(20)22)21-23-15-17(16-24-21)10-8-6-4-2/h11-12,14-16H,3-10,13H2,1-2H3