3-(5-bromanylpyridin-3-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid

Systemtic Name: 3-(5-bromanylpyridin-3-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Openeye Name: 3-(5-bromo-3-pyridyl)-3-(tert-butoxycarbonylamino)propanoic acid CAS Name: 3-(5-bromo-3-pyridinyl)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid IUPAC Name: 3-(5-bromopyridin-3-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Traditional Name: 3-(5-bromo-3-pyridyl)-3-(tert-butoxycarbonylamino)propionic acid Formula: C13H17BrN2O4 MolecularWeight: 345.18908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC(=CN=C1)Br

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC(=CN=C1)Br

InChI

InChI=1S/C13H17BrN2O4/c1-13(2,3)20-12(19)16-10(5-11(17)18)8-4-9(14)7-15-6-8/h4,6-7,10H,5H2,1-3H3,(H,16,19)(H,17,18)