6-(5-bromanyl-2-ethoxy-phenyl)-6,6-bis(fluoranyl)hexanoic acid

Systemtic Name: 6-(5-bromanyl-2-ethoxy-phenyl)-6,6-bis(fluoranyl)hexanoic acid Openeye Name: 6-(5-bromo-2-ethoxy-phenyl)-6,6-difluoro-hexanoic acid CAS Name: 6-(5-bromo-2-ethoxyphenyl)-6,6-difluorohexanoic acid IUPAC Name: 6-(5-bromo-2-ethoxyphenyl)-6,6-difluorohexanoic acid Traditional Name: 6-(5-bromo-2-ethoxy-phenyl)-6,6-difluoro-hexanoic acid Formula: C14H17BrF2O3 MolecularWeight: 351.183786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C(CCCCC(=O)O)(F)F

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C(CCCCC(=O)O)(F)F

InChI

InChI=1S/C14H17BrF2O3/c1-2-20-12-7-6-10(15)9-11(12)14(16,17)8-4-3-5-13(18)19/h6-7,9H,2-5,8H2,1H3,(H,18,19)