[(5R)-6-oxidanylideneundecan-5-yl] 3,3,3-tris(fluoranyl)-2-methoxy-2-phenyl-propanoate

Systemtic Name: [(5R)-6-oxidanylideneundecan-5-yl] 3,3,3-tris(fluoranyl)-2-methoxy-2-phenyl-propanoate Openeye Name: [(1R)-1-butyl-2-oxo-heptyl] 3,3,3-trifluoro-2-methoxy-2-phenyl-propanoate CAS Name: 3,3,3-trifluoro-2-methoxy-2-phenylpropanoic acid [(5R)-6-oxoundecan-5-yl] ester IUPAC Name: [(5R)-6-oxoundecan-5-yl] 3,3,3-trifluoro-2-methoxy-2-phenylpropanoate Traditional Name: 3,3,3-trifluoro-2-methoxy-2-phenyl-propionic acid [(1R)-1-butyl-2-keto-heptyl] ester Formula: C21H29F3O4 MolecularWeight: 402.44777

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCC(=O)[C@@H](CCCC)OC(=O)C(C1=CC=CC=C1)(C(F)(F)F)OC

InChI

InChI=1S/C21H29F3O4/c1-4-6-9-14-17(25)18(15-7-5-2)28-19(26)20(27-3,21(22,23)24)16-12-10-8-11-13-16/h8,10-13,18H,4-7,9,14-15H2,1-3H3/t18-,20?/m1/s1