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

Systemtic Name: cyclohexyl 2-[4-(5-decylpyrimidin-2-yl)phenyl]-2-fluoranyl-hexanoate Openeye Name: cyclohexyl 2-[4-(5-decylpyrimidin-2-yl)phenyl]-2-fluoro-hexanoate CAS Name: 2-[4-(5-decyl-2-pyrimidinyl)phenyl]-2-fluorohexanoic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-[4-(5-decylpyrimidin-2-yl)phenyl]-2-fluorohexanoate Traditional Name: 2-[4-(5-decylpyrimidin-2-yl)phenyl]-2-fluoro-hexanoic acid cyclohexyl ester Formula: C32H47FN2O2 MolecularWeight: 510.726183

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(CCCC)(C(=O)OC3CCCCC3)F

Isomeric SMILES

CCCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(CCCC)(C(=O)OC3CCCCC3)F

InChI

InChI=1S/C32H47FN2O2/c1-3-5-7-8-9-10-11-13-16-26-24-34-30(35-25-26)27-19-21-28(22-20-27)32(33,23-6-4-2)31(36)37-29-17-14-12-15-18-29/h19-22,24-25,29H,3-18,23H2,1-2H3