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

Systemtic Name: 3-fluoranyl-4-[3-[4-(4-pentylcyclohexyl)cyclohexyl]propoxy]benzenecarbonitrile Openeye Name: 3-fluoro-4-[3-[4-(4-pentylcyclohexyl)cyclohexyl]propoxy]benzonitrile CAS Name: 3-fluoro-4-[3-[4-(4-pentylcyclohexyl)cyclohexyl]propoxy]benzonitrile IUPAC Name: 3-fluoro-4-[3-[4-(4-pentylcyclohexyl)cyclohexyl]propoxy]benzonitrile Traditional Name: 4-[3-[4-(4-amylcyclohexyl)cyclohexyl]propoxy]-3-fluoro-benzonitrile Formula: C27H40FNO MolecularWeight: 413.611003

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2CCC(CC2)CCCOC3=C(C=C(C=C3)C#N)F

Isomeric SMILES

CCCCCC1CCC(CC1)C2CCC(CC2)CCCOC3=C(C=C(C=C3)C#N)F

InChI

InChI=1S/C27H40FNO/c1-2-3-4-6-21-8-13-24(14-9-21)25-15-10-22(11-16-25)7-5-18-30-27-17-12-23(20-29)19-26(27)28/h12,17,19,21-22,24-25H,2-11,13-16,18H2,1H3