3-(3-bromanyl-4-iodanyl-phenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: 3-(3-bromanyl-4-iodanyl-phenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: 3-(3-bromo-4-iodo-phenyl)-2-(tert-butoxycarbonylamino)propanoate CAS Name: 3-(3-bromo-4-iodophenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoate IUPAC Name: 3-(3-bromo-4-iodophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 3-(3-bromo-4-iodo-phenyl)-2-(tert-butoxycarbonylamino)propionate Formula: C14H16BrINO4- MolecularWeight: 469.08961

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC(=C(C=C1)I)Br)C(=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC(=C(C=C1)I)Br)C(=O)[O-]

InChI

InChI=1S/C14H17BrINO4/c1-14(2,3)21-13(20)17-11(12(18)19)7-8-4-5-10(16)9(15)6-8/h4-6,11H,7H2,1-3H3,(H,17,20)(H,18,19)/p-1