2-fluoranyl-1-[4-[4-(5-hexylpyridin-2-yl)phenyl]-1-oxidanyl-cyclohexyl]hexan-1-one

Systemtic Name: 2-fluoranyl-1-[4-[4-(5-hexylpyridin-2-yl)phenyl]-1-oxidanyl-cyclohexyl]hexan-1-one Openeye Name: 2-fluoro-1-[4-[4-(5-hexyl-2-pyridyl)phenyl]-1-hydroxy-cyclohexyl]hexan-1-one CAS Name: 2-fluoro-1-[4-[4-(5-hexyl-2-pyridinyl)phenyl]-1-hydroxycyclohexyl]-1-hexanone IUPAC Name: 2-fluoro-1-[4-[4-(5-hexylpyridin-2-yl)phenyl]-1-hydroxycyclohexyl]hexan-1-one Traditional Name: 2-fluoro-1-[4-[4-(5-hexyl-2-pyridyl)phenyl]-1-hydroxy-cyclohexyl]hexan-1-one Formula: C29H40FNO2 MolecularWeight: 453.631803

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)(C(=O)C(CCCC)F)O

Isomeric SMILES

CCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)(C(=O)C(CCCC)F)O

InChI

InChI=1S/C29H40FNO2/c1-3-5-7-8-9-22-11-16-27(31-21-22)25-14-12-23(13-15-25)24-17-19-29(33,20-18-24)28(32)26(30)10-6-4-2/h11-16,21,24,26,33H,3-10,17-20H2,1-2H3