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

Systemtic Name: 2-[4-[(E)-but-1-enyl]phenyl]-4-cyano-3-fluoranyl-benzoate Openeye Name: 2-[4-[(E)-but-1-enyl]phenyl]-4-cyano-3-fluoro-benzoate CAS Name: 2-[4-[(E)-but-1-enyl]phenyl]-4-cyano-3-fluorobenzoate IUPAC Name: 2-[4-[(E)-but-1-enyl]phenyl]-4-cyano-3-fluorobenzoate Traditional Name: 2-[4-[(E)-but-1-enyl]phenyl]-4-cyano-3-fluoro-benzoate Formula: C18H13FNO2- MolecularWeight: 294.299723

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14FNO2/c1-2-3-4-12-5-7-13(8-6-12)16-15(18(21)22)10-9-14(11-20)17(16)19/h3-10H,2H2,1H3,(H,21,22)/p-1/b4-3+