2-[4-(3-fluoranylbutoxy)phenyl]-5-tridecyl-pyrimidine

Systemtic Name: 2-[4-(3-fluoranylbutoxy)phenyl]-5-tridecyl-pyrimidine Openeye Name: 2-[4-(3-fluorobutoxy)phenyl]-5-tridecyl-pyrimidine CAS Name: 2-[4-(3-fluorobutoxy)phenyl]-5-tridecylpyrimidine IUPAC Name: 2-[4-(3-fluorobutoxy)phenyl]-5-tridecylpyrimidine Traditional Name: 2-[4-(3-fluorobutoxy)phenyl]-5-tridecyl-pyrimidine Formula: C27H41FN2O MolecularWeight: 428.625643

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(C)F

Isomeric SMILES

CCCCCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)OCCC(C)F

InChI

InChI=1S/C27H41FN2O/c1-3-4-5-6-7-8-9-10-11-12-13-14-24-21-29-27(30-22-24)25-15-17-26(18-16-25)31-20-19-23(2)28/h15-18,21-23H,3-14,19-20H2,1-2H3