methyl (2S)-3-[4-(5-iodanyl-2-methoxy-phenoxy)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: methyl (2S)-3-[4-(5-iodanyl-2-methoxy-phenoxy)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: methyl (2S)-2-(tert-butoxycarbonylamino)-3-[4-(5-iodo-2-methoxy-phenoxy)phenyl]propanoate CAS Name: (2S)-3-[4-(5-iodo-2-methoxyphenoxy)phenyl]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-[4-(5-iodo-2-methoxyphenoxy)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-3-[4-(5-iodo-2-methoxy-phenoxy)phenyl]propionic acid methyl ester Formula: C22H26INO6 MolecularWeight: 527.34941

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)OC2=C(C=CC(=C2)I)OC)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=C(C=C1)OC2=C(C=CC(=C2)I)OC)C(=O)OC

InChI

InChI=1S/C22H26INO6/c1-22(2,3)30-21(26)24-17(20(25)28-5)12-14-6-9-16(10-7-14)29-19-13-15(23)8-11-18(19)27-4/h6-11,13,17H,12H2,1-5H3,(H,24,26)/t17-/m0/s1