3,4-bis(fluoranyl)-2-[4-[(E)-pent-1-enyl]phenyl]benzoate

Systemtic Name: 3,4-bis(fluoranyl)-2-[4-[(E)-pent-1-enyl]phenyl]benzoate Openeye Name: 3,4-difluoro-2-[4-[(E)-pent-1-enyl]phenyl]benzoate CAS Name: 3,4-difluoro-2-[4-[(E)-pent-1-enyl]phenyl]benzoate IUPAC Name: 3,4-difluoro-2-[4-[(E)-pent-1-enyl]phenyl]benzoate Traditional Name: 3,4-difluoro-2-[4-[(E)-pent-1-enyl]phenyl]benzoate Formula: C18H15F2O2- MolecularWeight: 301.307306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC=CC1=CC=C(C=C1)C2=C(C=CC(=C2F)F)C(=O)[O-]

Isomeric SMILES

CCC/C=C/C1=CC=C(C=C1)C2=C(C=CC(=C2F)F)C(=O)[O-]

InChI

InChI=1S/C18H16F2O2/c1-2-3-4-5-12-6-8-13(9-7-12)16-14(18(21)22)10-11-15(19)17(16)20/h4-11H,2-3H2,1H3,(H,21,22)/p-1/b5-4+