1-(2-fluoranylhexyl)-4-[4-(5-pent-4-enylpyridin-2-yl)phenyl]cyclohexane-1-carbonitrile

Systemtic Name: 1-(2-fluoranylhexyl)-4-[4-(5-pent-4-enylpyridin-2-yl)phenyl]cyclohexane-1-carbonitrile Openeye Name: 1-(2-fluorohexyl)-4-[4-(5-pent-4-enyl-2-pyridyl)phenyl]cyclohexanecarbonitrile CAS Name: 1-(2-fluorohexyl)-4-[4-(5-pent-4-enyl-2-pyridinyl)phenyl]-1-cyclohexanecarbonitrile IUPAC Name: 1-(2-fluorohexyl)-4-[4-(5-pent-4-enylpyridin-2-yl)phenyl]cyclohexane-1-carbonitrile Traditional Name: 1-(2-fluorohexyl)-4-[4-(5-pent-4-enyl-2-pyridyl)phenyl]cyclohexanecarbonitrile Formula: C29H37FN2 MolecularWeight: 432.615883

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC1(CCC(CC1)C2=CC=C(C=C2)C3=NC=C(C=C3)CCCC=C)C#N)F

Isomeric SMILES

CCCCC(CC1(CCC(CC1)C2=CC=C(C=C2)C3=NC=C(C=C3)CCCC=C)C#N)F

InChI

InChI=1S/C29H37FN2/c1-3-5-7-8-23-10-15-28(32-21-23)26-13-11-24(12-14-26)25-16-18-29(22-31,19-17-25)20-27(30)9-6-4-2/h3,10-15,21,25,27H,1,4-9,16-20H2,2H3