3-(4-iodophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-propanoic acid

Systemtic Name: 3-(4-iodophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-2-oxidanyl-propanoic acid Openeye Name: 3-(tert-butoxycarbonylamino)-2-hydroxy-3-(4-iodophenyl)propanoic acid CAS Name: 2-hydroxy-3-(4-iodophenyl)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid IUPAC Name: 2-hydroxy-3-(4-iodophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Traditional Name: 3-(tert-butoxycarbonylamino)-2-hydroxy-3-(4-iodophenyl)propionic acid Formula: C14H18INO5 MolecularWeight: 407.20089

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18INO5/c1-14(2,3)21-13(20)16-10(11(17)12(18)19)8-4-6-9(15)7-5-8/h4-7,10-11,17H,1-3H3,(H,16,20)(H,18,19)