tert-butyl (2S)-2-[[(2R,3S)-3-oxidanyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]propanoate

Systemtic Name: tert-butyl (2S)-2-[[(2R,3S)-3-oxidanyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]propanoate Openeye Name: tert-butyl (2S)-2-[[(2R,3S)-2-(benzyloxycarbonylamino)-3-hydroxy-butanoyl]amino]propanoate CAS Name: (2S)-2-[[(2R,3S)-3-hydroxy-1-oxo-2-(phenylmethoxycarbonylamino)butyl]amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[(2R,3S)-3-hydroxy-2-(phenylmethoxycarbonylamino)butanoyl]amino]propanoate Traditional Name: (2S)-2-[[(2R,3S)-2-(benzyloxycarbonylamino)-3-hydroxy-butanoyl]amino]propionic acid tert-butyl ester Formula: C19H28N2O6 MolecularWeight: 380.43542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)NC(C)C(=O)OC(C)(C)C)NC(=O)OCC1=CC=CC=C1)O

Isomeric SMILES

C[C@@H]([C@H](C(=O)N[C@@H](C)C(=O)OC(C)(C)C)NC(=O)OCC1=CC=CC=C1)O

InChI

InChI=1S/C19H28N2O6/c1-12(17(24)27-19(3,4)5)20-16(23)15(13(2)22)21-18(25)26-11-14-9-7-6-8-10-14/h6-10,12-13,15,22H,11H2,1-5H3,(H,20,23)(H,21,25)/t12-,13-,15+/m0/s1