[4-oxidanylidene-2-(trifluoromethyl)-6,7,8,8a-tetrahydro-5H-chromen-4a-yl] ethanoate

Systemtic Name: [4-oxidanylidene-2-(trifluoromethyl)-6,7,8,8a-tetrahydro-5H-chromen-4a-yl] ethanoate Openeye Name: [4-oxo-2-(trifluoromethyl)-6,7,8,8a-tetrahydro-5H-chromen-4a-yl] acetate CAS Name: acetic acid [4-oxo-2-(trifluoromethyl)-6,7,8,8a-tetrahydro-5H-1-benzopyran-4a-yl] ester IUPAC Name: [4-oxo-2-(trifluoromethyl)-6,7,8,8a-tetrahydro-5H-chromen-4a-yl] acetate Traditional Name: acetic acid [4-keto-2-(trifluoromethyl)-6,7,8,8a-tetrahydro-5H-chromen-4a-yl] ester Formula: C12H13F3O4 MolecularWeight: 278.22443

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC12CCCCC1OC(=CC2=O)C(F)(F)F

Isomeric SMILES

CC(=O)OC12CCCCC1OC(=CC2=O)C(F)(F)F

InChI

InChI=1S/C12H13F3O4/c1-7(16)19-11-5-3-2-4-9(11)18-10(6-8(11)17)12(13,14)15/h6,9H,2-5H2,1H3