(3-fluoranyl-4-methoxy-phenyl)methyl (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl (2S)-2-(benzyloxycarbonylamino)-3-methyl-butanoate CAS Name: (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl (2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: (2S)-2-(benzyloxycarbonylamino)-3-methyl-butyric acid (3-fluoro-4-methoxy-benzyl) ester Formula: C21H24FNO5 MolecularWeight: 389.417363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC(=C(C=C1)OC)F)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC1=CC(=C(C=C1)OC)F)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H24FNO5/c1-14(2)19(23-21(25)28-12-15-7-5-4-6-8-15)20(24)27-13-16-9-10-18(26-3)17(22)11-16/h4-11,14,19H,12-13H2,1-3H3,(H,23,25)/t19-/m0/s1