[2,5-bis(fluoranyl)-6-(2-fluoranylethanoyl)-4-hexyl-3-oxidanyl-phenyl] ethanoate

Systemtic Name: [2,5-bis(fluoranyl)-6-(2-fluoranylethanoyl)-4-hexyl-3-oxidanyl-phenyl] ethanoate Openeye Name: [2,5-difluoro-6-(2-fluoroacetyl)-4-hexyl-3-hydroxy-phenyl] acetate CAS Name: acetic acid [2,5-difluoro-6-(2-fluoro-1-oxoethyl)-4-hexyl-3-hydroxyphenyl] ester IUPAC Name: [2,5-difluoro-6-(2-fluoroacetyl)-4-hexyl-3-hydroxyphenyl] acetate Traditional Name: acetic acid [2,5-difluoro-6-(2-fluoroacetyl)-4-hexyl-3-hydroxy-phenyl] ester Formula: C16H19F3O4 MolecularWeight: 332.31487

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=C(C(=C1O)F)OC(=O)C)C(=O)CF)F

Isomeric SMILES

CCCCCCC1=C(C(=C(C(=C1O)F)OC(=O)C)C(=O)CF)F

InChI

InChI=1S/C16H19F3O4/c1-3-4-5-6-7-10-13(18)12(11(21)8-17)16(23-9(2)20)14(19)15(10)22/h22H,3-8H2,1-2H3