4-[2-[4-(4-decylcyclohexyl)cyclohexen-1-yl]ethyl]-2-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-[2-[4-(4-decylcyclohexyl)cyclohexen-1-yl]ethyl]-2-fluoranyl-benzenecarbonitrile Openeye Name: 4-[2-[4-(4-decylcyclohexyl)cyclohexen-1-yl]ethyl]-2-fluoro-benzonitrile CAS Name: 4-[2-[4-(4-decylcyclohexyl)-1-cyclohexenyl]ethyl]-2-fluorobenzonitrile IUPAC Name: 4-[2-[4-(4-decylcyclohexyl)cyclohexen-1-yl]ethyl]-2-fluorobenzonitrile Traditional Name: 4-[2-[4-(4-decylcyclohexyl)cyclohexen-1-yl]ethyl]-2-fluoro-benzonitrile Formula: C31H46FN MolecularWeight: 451.702043

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1CCC(CC1)C2CCC(=CC2)CCC3=CC(=C(C=C3)C#N)F

Isomeric SMILES

CCCCCCCCCCC1CCC(CC1)C2CCC(=CC2)CCC3=CC(=C(C=C3)C#N)F

InChI

InChI=1S/C31H46FN/c1-2-3-4-5-6-7-8-9-10-25-13-18-28(19-14-25)29-20-15-26(16-21-29)11-12-27-17-22-30(24-33)31(32)23-27/h15,17,22-23,25,28-29H,2-14,16,18-21H2,1H3