cyclohexyl 2-fluoranyl-3-methyl-2-[4-(5-pentylpyrimidin-2-yl)phenyl]pentanoate

Systemtic Name: cyclohexyl 2-fluoranyl-3-methyl-2-[4-(5-pentylpyrimidin-2-yl)phenyl]pentanoate Openeye Name: cyclohexyl 2-fluoro-3-methyl-2-[4-(5-pentylpyrimidin-2-yl)phenyl]pentanoate CAS Name: 2-fluoro-3-methyl-2-[4-(5-pentyl-2-pyrimidinyl)phenyl]pentanoic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-fluoro-3-methyl-2-[4-(5-pentylpyrimidin-2-yl)phenyl]pentanoate Traditional Name: 2-[4-(5-amylpyrimidin-2-yl)phenyl]-2-fluoro-3-methyl-valeric acid cyclohexyl ester Formula: C27H37FN2O2 MolecularWeight: 440.593283

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(C(C)CC)(C(=O)OC3CCCCC3)F

Isomeric SMILES

CCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)C(C(C)CC)(C(=O)OC3CCCCC3)F

InChI

InChI=1S/C27H37FN2O2/c1-4-6-8-11-21-18-29-25(30-19-21)22-14-16-23(17-15-22)27(28,20(3)5-2)26(31)32-24-12-9-7-10-13-24/h14-20,24H,4-13H2,1-3H3