ethyl (2S)-2-acetamido-3,3,3-tris(fluoranyl)-2-phenylmethoxy-propanoate

Systemtic Name: ethyl (2S)-2-acetamido-3,3,3-tris(fluoranyl)-2-phenylmethoxy-propanoate Openeye Name: ethyl (2S)-2-acetamido-2-benzyloxy-3,3,3-trifluoro-propanoate CAS Name: (2S)-2-acetamido-3,3,3-trifluoro-2-phenylmethoxypropanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-acetamido-3,3,3-trifluoro-2-phenylmethoxypropanoate Traditional Name: (2S)-2-acetamido-2-benzoxy-3,3,3-trifluoro-propionic acid ethyl ester Formula: C14H16F3NO4 MolecularWeight: 319.27635

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(F)(F)F)(NC(=O)C)OCC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)[C@](C(F)(F)F)(NC(=O)C)OCC1=CC=CC=C1

InChI

InChI=1S/C14H16F3NO4/c1-3-21-12(20)13(14(15,16)17,18-10(2)19)22-9-11-7-5-4-6-8-11/h4-8H,3,9H2,1-2H3,(H,18,19)/t13-/m0/s1