3-[3,5-bis(iodanyl)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid

Systemtic Name: 3-[3,5-bis(iodanyl)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-3-(3,5-diiodophenyl)propanoic acid CAS Name: 3-(3,5-diiodophenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid IUPAC Name: 3-(3,5-diiodophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-3-(3,5-diiodophenyl)propionic acid Formula: C14H17I2NO4 MolecularWeight: 517.09802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17I2NO4/c1-14(2,3)21-13(20)17-11(12(18)19)6-8-4-9(15)7-10(16)5-8/h4-5,7,11H,6H2,1-3H3,(H,17,20)(H,18,19)