ethyl (2R,3R)-3-(3-chloranyl-4-phenylmethoxy-phenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-propanoate

Systemtic Name: ethyl (2R,3R)-3-(3-chloranyl-4-phenylmethoxy-phenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanyl-propanoate Openeye Name: ethyl (2R,3R)-3-(4-benzyloxy-3-chloro-phenyl)-2-(tert-butoxycarbonylamino)-3-hydroxy-propanoate CAS Name: (2R,3R)-3-(3-chloro-4-phenylmethoxyphenyl)-3-hydroxy-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl (2R,3R)-3-(3-chloro-4-phenylmethoxyphenyl)-3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2R,3R)-3-(4-benzoxy-3-chloro-phenyl)-2-(tert-butoxycarbonylamino)-3-hydroxy-propionic acid ethyl ester Formula: C23H28ClNO6 MolecularWeight: 449.92452

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC(=C(C=C1)OCC2=CC=CC=C2)Cl)O)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)[C@@H]([C@@H](C1=CC(=C(C=C1)OCC2=CC=CC=C2)Cl)O)NC(=O)OC(C)(C)C

InChI

InChI=1S/C23H28ClNO6/c1-5-29-21(27)19(25-22(28)31-23(2,3)4)20(26)16-11-12-18(17(24)13-16)30-14-15-9-7-6-8-10-15/h6-13,19-20,26H,5,14H2,1-4H3,(H,25,28)/t19-,20-/m1/s1