1-phenylethyl 2-decoxy-3,3,3-tris(fluoranyl)propanoate

Systemtic Name: 1-phenylethyl 2-decoxy-3,3,3-tris(fluoranyl)propanoate Openeye Name: 1-phenylethyl 2-decoxy-3,3,3-trifluoro-propanoate CAS Name: 2-decoxy-3,3,3-trifluoropropanoic acid 1-phenylethyl ester IUPAC Name: 1-phenylethyl 2-decoxy-3,3,3-trifluoropropanoate Traditional Name: 2-decoxy-3,3,3-trifluoro-propionic acid 1-phenylethyl ester Formula: C21H31F3O3 MolecularWeight: 388.46425

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC(C(=O)OC(C)C1=CC=CC=C1)C(F)(F)F

Isomeric SMILES

CCCCCCCCCCOC(C(=O)OC(C)C1=CC=CC=C1)C(F)(F)F

InChI

InChI=1S/C21H31F3O3/c1-3-4-5-6-7-8-9-13-16-26-19(21(22,23)24)20(25)27-17(2)18-14-11-10-12-15-18/h10-12,14-15,17,19H,3-9,13,16H2,1-2H3