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4-cyano-3-fluoranyl-2-[4-[(E)-oct-1-enyl]phenyl]benzoate

4-cyano-3-fluoranyl-2-[4-[(E)-oct-1-enyl]phenyl]benzoate

Systemtic Name:4-cyano-3-fluoranyl-2-[4-[(E)-oct-1-enyl]phenyl]benzoate
Openeye Name:4-cyano-3-fluoro-2-[4-[(E)-oct-1-enyl]phenyl]benzoate
CAS Name:4-cyano-3-fluoro-2-[4-[(E)-oct-1-enyl]phenyl]benzoate
IUPAC Name:4-cyano-3-fluoro-2-[4-[(E)-oct-1-enyl]phenyl]benzoate
Traditional Name:4-cyano-3-fluoro-2-[4-[(E)-oct-1-enyl]phenyl]benzoate
Formula: C22H21FNO2-
MolecularWeight: 350.406043
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CC1=CC=C(C=C1)C2=C(C=CC(=C2F)C#N)C(=O)[O-]


Isomeric SMILES

CCCCCC/C=C/C1=CC=C(C=C1)C2=C(C=CC(=C2F)C#N)C(=O)[O-]


InChI

InChI=1S/C22H22FNO2/c1-2-3-4-5-6-7-8-16-9-11-17(12-10-16)20-19(22(25)26)14-13-18(15-24)21(20)23/h7-14H,2-6H2,1H3,(H,25,26)/p-1/b8-7+


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