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

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

Systemtic Name:4-cyano-3-fluoranyl-2-[4-[(E)-hept-1-enyl]phenyl]benzoate
Openeye Name:4-cyano-3-fluoro-2-[4-[(E)-hept-1-enyl]phenyl]benzoate
CAS Name:4-cyano-3-fluoro-2-[4-[(E)-hept-1-enyl]phenyl]benzoate
IUPAC Name:4-cyano-3-fluoro-2-[4-[(E)-hept-1-enyl]phenyl]benzoate
Traditional Name:4-cyano-3-fluoro-2-[4-[(E)-hept-1-enyl]phenyl]benzoate
Formula: C21H19FNO2-
MolecularWeight: 336.379463
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C21H20FNO2/c1-2-3-4-5-6-7-15-8-10-16(11-9-15)19-18(21(24)25)13-12-17(14-23)20(19)22/h6-13H,2-5H2,1H3,(H,24,25)/p-1/b7-6+


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