[(1S,6S)-6-acetyloxy-5-(trifluoromethyl)cyclohexa-2,4-dien-1-yl] ethanoate

Systemtic Name: [(1S,6S)-6-acetyloxy-5-(trifluoromethyl)cyclohexa-2,4-dien-1-yl] ethanoate Openeye Name: [(1S,6S)-6-acetoxy-5-(trifluoromethyl)cyclohexa-2,4-dien-1-yl] acetate CAS Name: acetic acid [(1S,6S)-6-acetyloxy-5-(trifluoromethyl)-1-cyclohexa-2,4-dienyl] ester IUPAC Name: [(1S,6S)-6-acetyloxy-5-(trifluoromethyl)cyclohexa-2,4-dien-1-yl] acetate Traditional Name: acetic acid [(1S,6S)-6-acetoxy-5-(trifluoromethyl)cyclohexa-2,4-dien-1-yl] ester Formula: C11H11F3O4 MolecularWeight: 264.19785

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C=CC=C(C1OC(=O)C)C(F)(F)F

Isomeric SMILES

CC(=O)O[C@H]1C=CC=C([C@@H]1OC(=O)C)C(F)(F)F

InChI

InChI=1S/C11H11F3O4/c1-6(15)17-9-5-3-4-8(11(12,13)14)10(9)18-7(2)16/h3-5,9-10H,1-2H3/t9-,10-/m0/s1