1-(2-fluoranylhexanoyl)-4-[4-(5-hex-5-enylpyridin-2-yl)phenyl]cyclohexan-1-olate

Systemtic Name: 1-(2-fluoranylhexanoyl)-4-[4-(5-hex-5-enylpyridin-2-yl)phenyl]cyclohexan-1-olate Openeye Name: 1-(2-fluorohexanoyl)-4-[4-(5-hex-5-enyl-2-pyridyl)phenyl]cyclohexanolate CAS Name: 1-(2-fluoro-1-oxohexyl)-4-[4-(5-hex-5-enyl-2-pyridinyl)phenyl]-1-cyclohexanolate IUPAC Name: 1-(2-fluorohexanoyl)-4-[4-(5-hex-5-enylpyridin-2-yl)phenyl]cyclohexan-1-olate Traditional Name: 1-(2-fluorohexanoyl)-4-[4-(5-hex-5-enyl-2-pyridyl)phenyl]cyclohexanolate Formula: C29H37FNO2- MolecularWeight: 450.607983

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)C1(CCC(CC1)C2=CC=C(C=C2)C3=NC=C(C=C3)CCCCC=C)[O-])F

Isomeric SMILES

CCCCC(C(=O)C1(CCC(CC1)C2=CC=C(C=C2)C3=NC=C(C=C3)CCCCC=C)[O-])F

InChI

InChI=1S/C29H37FNO2/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/h3,11-16,21,24,26H,1,4-10,17-20H2,2H3/q-1