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

Systemtic Name: 2-fluoranyl-1-[4-[4-(5-heptylpyridin-2-yl)phenyl]-1-oxidanyl-cyclohexyl]hexan-1-one Openeye Name: 2-fluoro-1-[4-[4-(5-heptyl-2-pyridyl)phenyl]-1-hydroxy-cyclohexyl]hexan-1-one CAS Name: 2-fluoro-1-[4-[4-(5-heptyl-2-pyridinyl)phenyl]-1-hydroxycyclohexyl]-1-hexanone IUPAC Name: 2-fluoro-1-[4-[4-(5-heptylpyridin-2-yl)phenyl]-1-hydroxycyclohexyl]hexan-1-one Traditional Name: 2-fluoro-1-[4-[4-(5-heptyl-2-pyridyl)phenyl]-1-hydroxy-cyclohexyl]hexan-1-one Formula: C30H42FNO2 MolecularWeight: 467.658383

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)(C(=O)C(CCCC)F)O

Isomeric SMILES

CCCCCCCC1=CN=C(C=C1)C2=CC=C(C=C2)C3CCC(CC3)(C(=O)C(CCCC)F)O

InChI

InChI=1S/C30H42FNO2/c1-3-5-7-8-9-10-23-12-17-28(32-22-23)26-15-13-24(14-16-26)25-18-20-30(34,21-19-25)29(33)27(31)11-6-4-2/h12-17,22,25,27,34H,3-11,18-21H2,1-2H3