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

Systemtic Name: (phenylmethyl) 3-methyl-2-[[(2S)-3-oxidanyl-2-(phenylmethoxycarbonylamino)propanoyl]amino]butanoate Openeye Name: benzyl 2-[[(2S)-2-(benzyloxycarbonylamino)-3-hydroxy-propanoyl]amino]-3-methyl-butanoate CAS Name: 2-[[(2S)-3-hydroxy-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]-3-methylbutanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[(2S)-3-hydroxy-2-(phenylmethoxycarbonylamino)propanoyl]amino]-3-methylbutanoate Traditional Name: 2-[[(2S)-2-(benzyloxycarbonylamino)-3-hydroxy-propanoyl]amino]-3-methyl-butyric acid benzyl ester Formula: C23H28N2O6 MolecularWeight: 428.47822

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N2O6/c1-16(2)20(22(28)30-14-17-9-5-3-6-10-17)25-21(27)19(13-26)24-23(29)31-15-18-11-7-4-8-12-18/h3-12,16,19-20,26H,13-15H2,1-2H3,(H,24,29)(H,25,27)/t19-,20?/m0/s1