[2,6-bis(fluoranyl)phenyl]methyl 3-methylbutanoate

Systemtic Name: [2,6-bis(fluoranyl)phenyl]methyl 3-methylbutanoate Openeye Name: (2,6-difluorophenyl)methyl 3-methylbutanoate CAS Name: 3-methylbutanoic acid (2,6-difluorophenyl)methyl ester IUPAC Name: (2,6-difluorophenyl)methyl 3-methylbutanoate Traditional Name: 3-methylbutyric acid (2,6-difluorobenzyl) ester Formula: C12H14F2O2 MolecularWeight: 228.235166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)OCC1=C(C=CC=C1F)F

Isomeric SMILES

CC(C)CC(=O)OCC1=C(C=CC=C1F)F

InChI

InChI=1S/C12H14F2O2/c1-8(2)6-12(15)16-7-9-10(13)4-3-5-11(9)14/h3-5,8H,6-7H2,1-2H3