3-fluoranyl-4-[3-(4-pentylcyclohexyl)propoxy]benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-[3-(4-pentylcyclohexyl)propoxy]benzenecarbonitrile Openeye Name: 3-fluoro-4-[3-(4-pentylcyclohexyl)propoxy]benzonitrile CAS Name: 3-fluoro-4-[3-(4-pentylcyclohexyl)propoxy]benzonitrile IUPAC Name: 3-fluoro-4-[3-(4-pentylcyclohexyl)propoxy]benzonitrile Traditional Name: 4-[3-(4-amylcyclohexyl)propoxy]-3-fluoro-benzonitrile Formula: C21H30FNO MolecularWeight: 331.467403

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)CCCOC2=C(C=C(C=C2)C#N)F

Isomeric SMILES

CCCCCC1CCC(CC1)CCCOC2=C(C=C(C=C2)C#N)F

InChI

InChI=1S/C21H30FNO/c1-2-3-4-6-17-8-10-18(11-9-17)7-5-14-24-21-13-12-19(16-23)15-20(21)22/h12-13,15,17-18H,2-11,14H2,1H3