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

Systemtic Name: ethyl (2S,3R)-3-(4-chlorophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-propanoate Openeye Name: ethyl (2S,3R)-2-(tert-butoxycarbonylamino)-3-(4-chlorophenyl)-3-hydroxy-propanoate CAS Name: (2S,3R)-3-(4-chlorophenyl)-3-hydroxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl (2S,3R)-3-(4-chlorophenyl)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2S,3R)-2-(tert-butoxycarbonylamino)-3-(4-chlorophenyl)-3-hydroxy-propionic acid ethyl ester Formula: C16H22ClNO5 MolecularWeight: 343.80258

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=C(C=C1)Cl)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)[C@H]([C@@H](C1=CC=C(C=C1)Cl)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C16H22ClNO5/c1-5-22-14(20)12(18-15(21)23-16(2,3)4)13(19)10-6-8-11(17)9-7-10/h6-9,12-13,19H,5H2,1-4H3,(H,18,21)/t12-,13+/m0/s1