methyl 2-oxidanylidene-4-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]butanoate

Systemtic Name: methyl 2-oxidanylidene-4-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]butanoate Openeye Name: methyl 4-[[(2S)-2-(benzyloxycarbonylamino)propanoyl]amino]-2-oxo-butanoate CAS Name: 2-oxo-4-[[(2S)-1-oxo-2-(phenylmethoxycarbonylamino)propyl]amino]butanoic acid methyl ester IUPAC Name: methyl 2-oxo-4-[[(2S)-2-(phenylmethoxycarbonylamino)propanoyl]amino]butanoate Traditional Name: 4-[[(2S)-2-(benzyloxycarbonylamino)propanoyl]amino]-2-keto-butyric acid methyl ester Formula: C16H20N2O6 MolecularWeight: 336.3398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O6/c1-11(14(20)17-9-8-13(19)15(21)23-2)18-16(22)24-10-12-6-4-3-5-7-12/h3-7,11H,8-10H2,1-2H3,(H,17,20)(H,18,22)/t11-/m0/s1