ethyl (2S)-2-oxidanyl-2-(2-oxidanylidenecyclohexyl)-2-[4-(trifluoromethyl)phenyl]ethanoate

Systemtic Name: ethyl (2S)-2-oxidanyl-2-(2-oxidanylidenecyclohexyl)-2-[4-(trifluoromethyl)phenyl]ethanoate Openeye Name: ethyl (2S)-2-hydroxy-2-(2-oxocyclohexyl)-2-[4-(trifluoromethyl)phenyl]acetate CAS Name: (2S)-2-hydroxy-2-(2-oxocyclohexyl)-2-[4-(trifluoromethyl)phenyl]acetic acid ethyl ester IUPAC Name: ethyl (2S)-2-hydroxy-2-(2-oxocyclohexyl)-2-[4-(trifluoromethyl)phenyl]acetate Traditional Name: (2S)-2-hydroxy-2-(2-ketocyclohexyl)-2-[4-(trifluoromethyl)phenyl]acetic acid ethyl ester Formula: C17H19F3O4 MolecularWeight: 344.32557

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1CCCCC1=O)(C2=CC=C(C=C2)C(F)(F)F)O

Isomeric SMILES

CCOC(=O)[C@](C1CCCCC1=O)(C2=CC=C(C=C2)C(F)(F)F)O

InChI

InChI=1S/C17H19F3O4/c1-2-24-15(22)16(23,13-5-3-4-6-14(13)21)11-7-9-12(10-8-11)17(18,19)20/h7-10,13,23H,2-6H2,1H3/t13?,16-/m1/s1