(phenylmethyl) (2S)-2-[[(3S)-2-oxidanyl-4-phenyl-3-(phenylmethoxycarbonylamino)butanoyl]amino]propanoate

Systemtic Name: (phenylmethyl) (2S)-2-[[(3S)-2-oxidanyl-4-phenyl-3-(phenylmethoxycarbonylamino)butanoyl]amino]propanoate Openeye Name: benzyl (2S)-2-[[(3S)-3-(benzyloxycarbonylamino)-2-hydroxy-4-phenyl-butanoyl]amino]propanoate CAS Name: (2S)-2-[[(3S)-2-hydroxy-1-oxo-4-phenyl-3-(phenylmethoxycarbonylamino)butyl]amino]propanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-2-[[(3S)-2-hydroxy-4-phenyl-3-(phenylmethoxycarbonylamino)butanoyl]amino]propanoate Traditional Name: (2S)-2-[[(3S)-3-(benzyloxycarbonylamino)-2-hydroxy-4-phenyl-butanoyl]amino]propionic acid benzyl ester Formula: C28H30N2O6 MolecularWeight: 490.5476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC1=CC=CC=C1)NC(=O)C(C(CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)O

Isomeric SMILES

C[C@@H](C(=O)OCC1=CC=CC=C1)NC(=O)C([C@H](CC2=CC=CC=C2)NC(=O)OCC3=CC=CC=C3)O

InChI

InChI=1S/C28H30N2O6/c1-20(27(33)35-18-22-13-7-3-8-14-22)29-26(32)25(31)24(17-21-11-5-2-6-12-21)30-28(34)36-19-23-15-9-4-10-16-23/h2-16,20,24-25,31H,17-19H2,1H3,(H,29,32)(H,30,34)/t20-,24-,25?/m0/s1