methyl (2S)-3-(2-cyanoethoxy)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: methyl (2S)-3-(2-cyanoethoxy)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: methyl (2S)-2-(tert-butoxycarbonylamino)-3-(2-cyanoethoxy)propanoate CAS Name: (2S)-3-(2-cyanoethoxy)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(2-cyanoethoxy)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-3-(2-cyanoethoxy)propionic acid methyl ester Formula: C12H20N2O5 MolecularWeight: 272.2976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(COCCC#N)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](COCCC#N)C(=O)OC

InChI

InChI=1S/C12H20N2O5/c1-12(2,3)19-11(16)14-9(10(15)17-4)8-18-7-5-6-13/h9H,5,7-8H2,1-4H3,(H,14,16)/t9-/m0/s1