methyl (2R)-3-(2-cyanoethylsulfinyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: methyl (2R)-3-(2-cyanoethylsulfinyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: methyl (2R)-2-(tert-butoxycarbonylamino)-3-(2-cyanoethylsulfinyl)propanoate CAS Name: (2R)-3-(2-cyanoethylsulfinyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-3-(2-cyanoethylsulfinyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2R)-2-(tert-butoxycarbonylamino)-3-(2-cyanoethylsulfinyl)propionic acid methyl ester Formula: C12H20N2O5S MolecularWeight: 304.3626

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CS(=O)CCC#N)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C12H20N2O5S/c1-12(2,3)19-11(16)14-9(10(15)18-4)8-20(17)7-5-6-13/h9H,5,7-8H2,1-4H3,(H,14,16)/t9-,20?/m0/s1