4-[4-[4-[(E)-4-cyano-4-fluoranyl-but-3-enyl]cyclohexyl]cyclohexyl]benzenecarbonitrile

Systemtic Name: 4-[4-[4-[(E)-4-cyano-4-fluoranyl-but-3-enyl]cyclohexyl]cyclohexyl]benzenecarbonitrile Openeye Name: 4-[4-[4-[(E)-4-cyano-4-fluoro-but-3-enyl]cyclohexyl]cyclohexyl]benzonitrile CAS Name: 4-[4-[4-[(E)-4-cyano-4-fluorobut-3-enyl]cyclohexyl]cyclohexyl]benzonitrile IUPAC Name: 4-[4-[4-[(E)-4-cyano-4-fluorobut-3-enyl]cyclohexyl]cyclohexyl]benzonitrile Traditional Name: 4-[4-[4-[(E)-4-cyano-4-fluoro-but-3-enyl]cyclohexyl]cyclohexyl]benzonitrile Formula: C24H29FN2 MolecularWeight: 364.498863

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CCC=C(C#N)F)C2CCC(CC2)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CC(CCC1CC/C=C(\C#N)/F)C2CCC(CC2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C24H29FN2/c25-24(17-27)3-1-2-18-4-8-20(9-5-18)22-12-14-23(15-13-22)21-10-6-19(16-26)7-11-21/h3,6-7,10-11,18,20,22-23H,1-2,4-5,8-9,12-15H2/b24-3+