cyclohexyl 2-fluoranyl-2-[4-(5-octylpyrimidin-2-yl)phenyl]hexanoate

Systemtic Name: cyclohexyl 2-fluoranyl-2-[4-(5-octylpyrimidin-2-yl)phenyl]hexanoate Openeye Name: cyclohexyl 2-fluoro-2-[4-(5-octylpyrimidin-2-yl)phenyl]hexanoate CAS Name: 2-fluoro-2-[4-(5-octyl-2-pyrimidinyl)phenyl]hexanoic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-fluoro-2-[4-(5-octylpyrimidin-2-yl)phenyl]hexanoate Traditional Name: 2-fluoro-2-[4-(5-octylpyrimidin-2-yl)phenyl]hexanoic acid cyclohexyl ester Formula: C30H43FN2O2 MolecularWeight: 482.673023

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(CCCC)(C(=O)OC3CCCCC3)F

Isomeric SMILES

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(CCCC)(C(=O)OC3CCCCC3)F

InChI

InChI=1S/C30H43FN2O2/c1-3-5-7-8-9-11-14-24-22-32-28(33-23-24)25-17-19-26(20-18-25)30(31,21-6-4-2)29(34)35-27-15-12-10-13-16-27/h17-20,22-23,27H,3-16,21H2,1-2H3