methyl (2S,3R)-3-(4-cyanophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl (2S,3R)-3-(4-cyanophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-propanoate Openeye Name: methyl (2S,3R)-2-(tert-butoxycarbonylamino)-3-(4-cyanophenyl)-3-hydroxy-propanoate CAS Name: (2S,3R)-3-(4-cyanophenyl)-3-hydroxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S,3R)-3-(4-cyanophenyl)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2S,3R)-2-(tert-butoxycarbonylamino)-3-(4-cyanophenyl)-3-hydroxy-propionic acid methyl ester Formula: C16H20N2O5 MolecularWeight: 320.3404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C(C1=CC=C(C=C1)C#N)O)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H]([C@@H](C1=CC=C(C=C1)C#N)O)C(=O)OC

InChI

InChI=1S/C16H20N2O5/c1-16(2,3)23-15(21)18-12(14(20)22-4)13(19)11-7-5-10(9-17)6-8-11/h5-8,12-13,19H,1-4H3,(H,18,21)/t12-,13+/m0/s1