[(1S)-2-oxidanylidenecyclohexyl] 5-[3-(trifluoromethyl)phenyl]furan-2-carboxylate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] 5-[3-(trifluoromethyl)phenyl]furan-2-carboxylate Openeye Name: [(1S)-2-oxocyclohexyl] 5-[3-(trifluoromethyl)phenyl]furan-2-carboxylate CAS Name: 5-[3-(trifluoromethyl)phenyl]-2-furancarboxylic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] 5-[3-(trifluoromethyl)phenyl]furan-2-carboxylate Traditional Name: 5-[3-(trifluoromethyl)phenyl]furan-2-carboxylic acid [(1S)-2-ketocyclohexyl] ester Formula: C18H15F3O4 MolecularWeight: 352.30451

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)C(C1)OC(=O)C2=CC=C(O2)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1CCC(=O)[C@H](C1)OC(=O)C2=CC=C(O2)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C18H15F3O4/c19-18(20,21)12-5-3-4-11(10-12)14-8-9-16(24-14)17(23)25-15-7-2-1-6-13(15)22/h3-5,8-10,15H,1-2,6-7H2/t15-/m0/s1