ethyl (2R)-3,3,3-tris(fluoranyl)-2-(3-methylbutanoylamino)-2-propoxy-propanoate

Systemtic Name: ethyl (2R)-3,3,3-tris(fluoranyl)-2-(3-methylbutanoylamino)-2-propoxy-propanoate Openeye Name: ethyl (2R)-3,3,3-trifluoro-2-(3-methylbutanoylamino)-2-propoxy-propanoate CAS Name: (2R)-3,3,3-trifluoro-2-[(3-methyl-1-oxobutyl)amino]-2-propoxypropanoic acid ethyl ester IUPAC Name: ethyl (2R)-3,3,3-trifluoro-2-(3-methylbutanoylamino)-2-propoxypropanoate Traditional Name: (2R)-3,3,3-trifluoro-2-(isovalerylamino)-2-propoxy-propionic acid ethyl ester Formula: C13H22F3NO4 MolecularWeight: 313.31329

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(C(=O)OCC)(C(F)(F)F)NC(=O)CC(C)C

Isomeric SMILES

CCCO[C@](C(=O)OCC)(C(F)(F)F)NC(=O)CC(C)C

InChI

InChI=1S/C13H22F3NO4/c1-5-7-21-12(13(14,15)16,11(19)20-6-2)17-10(18)8-9(3)4/h9H,5-8H2,1-4H3,(H,17,18)/t12-/m1/s1