(phenylmethyl) (2S)-2-[[(2S)-3-oxidanyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]propanoate

Systemtic Name: (phenylmethyl) (2S)-2-[[(2S)-3-oxidanyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]propanoate Openeye Name: benzyl (2S)-2-[[(2S)-2-(benzyloxycarbonylamino)-3-hydroxy-propanoyl]amino]propanoate CAS Name: (2S)-2-[[(2S)-3-hydroxy-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[[(2S)-3-hydroxy-2-(phenylmethoxycarbonylamino)propanoyl]amino]propanoate Traditional Name: (2S)-2-[[(2S)-2-(benzyloxycarbonylamino)-3-hydroxy-propanoyl]amino]propionic acid benzyl ester Formula: C21H24N2O6 MolecularWeight: 400.42506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=CC=C1)NC(=O)C(CO)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O6/c1-15(20(26)28-13-16-8-4-2-5-9-16)22-19(25)18(12-24)23-21(27)29-14-17-10-6-3-7-11-17/h2-11,15,18,24H,12-14H2,1H3,(H,22,25)(H,23,27)/t15-,18-/m0/s1