2-[3,3-bis(fluoranyl)-2H-1,4-benzodioxin-6-yl]-3-methyl-butanoic acid

Systemtic Name: 2-[3,3-bis(fluoranyl)-2H-1,4-benzodioxin-6-yl]-3-methyl-butanoic acid Openeye Name: 2-(3,3-difluoro-2H-1,4-benzodioxin-6-yl)-3-methyl-butanoic acid CAS Name: 2-(3,3-difluoro-2H-1,4-benzodioxin-6-yl)-3-methylbutanoic acid IUPAC Name: 2-(3,3-difluoro-2H-1,4-benzodioxin-6-yl)-3-methylbutanoic acid Traditional Name: 2-(3,3-difluoro-2H-1,4-benzodioxin-6-yl)-3-methyl-butyric acid Formula: C13H14F2O4 MolecularWeight: 272.244666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC2=C(C=C1)OCC(O2)(F)F)C(=O)O

Isomeric SMILES

CC(C)C(C1=CC2=C(C=C1)OCC(O2)(F)F)C(=O)O

InChI

InChI=1S/C13H14F2O4/c1-7(2)11(12(16)17)8-3-4-9-10(5-8)19-13(14,15)6-18-9/h3-5,7,11H,6H2,1-2H3,(H,16,17)