2-fluoranyl-4-[5-[2-(4-heptylcyclohexyl)ethyl]-1,3-dioxan-2-yl]benzenecarbonitrile

Systemtic Name: 2-fluoranyl-4-[5-[2-(4-heptylcyclohexyl)ethyl]-1,3-dioxan-2-yl]benzenecarbonitrile Openeye Name: 2-fluoro-4-[5-[2-(4-heptylcyclohexyl)ethyl]-1,3-dioxan-2-yl]benzonitrile CAS Name: 2-fluoro-4-[5-[2-(4-heptylcyclohexyl)ethyl]-1,3-dioxan-2-yl]benzonitrile IUPAC Name: 2-fluoro-4-[5-[2-(4-heptylcyclohexyl)ethyl]-1,3-dioxan-2-yl]benzonitrile Traditional Name: 2-fluoro-4-[5-[2-(4-heptylcyclohexyl)ethyl]-1,3-dioxan-2-yl]benzonitrile Formula: C26H38FNO2 MolecularWeight: 415.583823

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(CC1)CCC2COC(OC2)C3=CC(=C(C=C3)C#N)F

Isomeric SMILES

CCCCCCCC1CCC(CC1)CCC2COC(OC2)C3=CC(=C(C=C3)C#N)F

InChI

InChI=1S/C26H38FNO2/c1-2-3-4-5-6-7-20-8-10-21(11-9-20)12-13-22-18-29-26(30-19-22)23-14-15-24(17-28)25(27)16-23/h14-16,20-22,26H,2-13,18-19H2,1H3