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

Systemtic Name: 3-(3-bromanylpyridin-2-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Openeye Name: 3-(3-bromo-2-pyridyl)-3-(tert-butoxycarbonylamino)propanoic acid CAS Name: 3-(3-bromo-2-pyridinyl)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid IUPAC Name: 3-(3-bromopyridin-2-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Traditional Name: 3-(3-bromo-2-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=C(C=CC=N1)Br

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC(=O)O)C1=C(C=CC=N1)Br

InChI

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