hexyl 3-[2,5-bis(fluoranyl)phenyl]propanoate

Systemtic Name: hexyl 3-[2,5-bis(fluoranyl)phenyl]propanoate Openeye Name: hexyl 3-(2,5-difluorophenyl)propanoate CAS Name: 3-(2,5-difluorophenyl)propanoic acid hexyl ester IUPAC Name: hexyl 3-(2,5-difluorophenyl)propanoate Traditional Name: 3-(2,5-difluorophenyl)propionic acid hexyl ester Formula: C15H20F2O2 MolecularWeight: 270.314906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)CCC1=C(C=CC(=C1)F)F

Isomeric SMILES

CCCCCCOC(=O)CCC1=C(C=CC(=C1)F)F

InChI

InChI=1S/C15H20F2O2/c1-2-3-4-5-10-19-15(18)9-6-12-11-13(16)7-8-14(12)17/h7-8,11H,2-6,9-10H2,1H3