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

Systemtic Name: methyl (2S)-3-[4-(5-iodanyl-2-phenylmethoxy-phenoxy)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: methyl (2S)-3-[4-(2-benzyloxy-5-iodo-phenoxy)phenyl]-2-(tert-butoxycarbonylamino)propanoate CAS Name: (2S)-3-[4-(5-iodo-2-phenylmethoxyphenoxy)phenyl]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-[4-(5-iodo-2-phenylmethoxyphenoxy)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2S)-3-[4-(2-benzoxy-5-iodo-phenoxy)phenyl]-2-(tert-butoxycarbonylamino)propionic acid methyl ester Formula: C28H30INO6 MolecularWeight: 603.44537

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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)OCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=CC=C(C=C1)OC2=C(C=CC(=C2)I)OCC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C28H30INO6/c1-28(2,3)36-27(32)30-23(26(31)33-4)16-19-10-13-22(14-11-19)35-25-17-21(29)12-15-24(25)34-18-20-8-6-5-7-9-20/h5-15,17,23H,16,18H2,1-4H3,(H,30,32)/t23-/m0/s1