[(3S)-1-oxidanyl-2-oxidanylidene-octan-3-yl] (2S)-3,3,3-tris(fluoranyl)-2-methoxy-2-phenyl-propanoate

Systemtic Name: [(3S)-1-oxidanyl-2-oxidanylidene-octan-3-yl] (2S)-3,3,3-tris(fluoranyl)-2-methoxy-2-phenyl-propanoate Openeye Name: [(1S)-1-(2-hydroxyacetyl)hexyl] (2S)-3,3,3-trifluoro-2-methoxy-2-phenyl-propanoate CAS Name: (2S)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoic acid [(3S)-1-hydroxy-2-oxooctan-3-yl] ester IUPAC Name: [(3S)-1-hydroxy-2-oxooctan-3-yl] (2S)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoate Traditional Name: (2S)-3,3,3-trifluoro-2-methoxy-2-phenyl-propionic acid [(1S)-1-glycoloylhexyl] ester Formula: C18H23F3O5 MolecularWeight: 376.36743

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(=O)CO)OC(=O)C(C1=CC=CC=C1)(C(F)(F)F)OC

Isomeric SMILES

CCCCC[C@@H](C(=O)CO)OC(=O)[C@@](C1=CC=CC=C1)(C(F)(F)F)OC

InChI

InChI=1S/C18H23F3O5/c1-3-4-6-11-15(14(23)12-22)26-16(24)17(25-2,18(19,20)21)13-9-7-5-8-10-13/h5,7-10,15,22H,3-4,6,11-12H2,1-2H3/t15-,17-/m0/s1