[(2R)-26-methoxy-24-oxidanylidene-hexacosan-2-yl] (2S)-3,3,3-tris(fluoranyl)-2-methoxy-2-phenyl-propanoate

Systemtic Name: [(2R)-26-methoxy-24-oxidanylidene-hexacosan-2-yl] (2S)-3,3,3-tris(fluoranyl)-2-methoxy-2-phenyl-propanoate Openeye Name: [(1R)-25-methoxy-1-methyl-23-oxo-pentacosyl] (2S)-3,3,3-trifluoro-2-methoxy-2-phenyl-propanoate CAS Name: (2S)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoic acid [(2R)-26-methoxy-24-oxohexacosan-2-yl] ester IUPAC Name: [(2R)-26-methoxy-24-oxohexacosan-2-yl] (2S)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoate Traditional Name: (2S)-3,3,3-trifluoro-2-methoxy-2-phenyl-propionic acid [(1R)-23-keto-25-methoxy-1-methyl-pentacosyl] ester Formula: C37H61F3O5 MolecularWeight: 642.87245

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCCCCCCCCCCCCCCCCCCC(=O)CCOC)OC(=O)C(C1=CC=CC=C1)(C(F)(F)F)OC

Isomeric SMILES

C[C@H](CCCCCCCCCCCCCCCCCCCCCC(=O)CCOC)OC(=O)[C@@](C1=CC=CC=C1)(C(F)(F)F)OC

InChI

InChI=1S/C37H61F3O5/c1-32(45-35(42)36(44-3,37(38,39)40)33-27-23-21-24-28-33)26-22-19-17-15-13-11-9-7-5-4-6-8-10-12-14-16-18-20-25-29-34(41)30-31-43-2/h21,23-24,27-28,32H,4-20,22,25-26,29-31H2,1-3H3/t32-,36+/m1/s1