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

Systemtic Name: 3-[(3-azanylpyridin-2-yl)amino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Openeye Name: 3-[(3-amino-2-pyridyl)amino]-2-(tert-butoxycarbonylamino)propanoic acid CAS Name: 3-[(3-amino-2-pyridinyl)amino]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid IUPAC Name: 3-[(3-aminopyridin-2-yl)amino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Traditional Name: 3-[(3-amino-2-pyridyl)amino]-2-(tert-butoxycarbonylamino)propionic acid Formula: C13H20N4O4 MolecularWeight: 296.3223

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CNC1=C(C=CC=N1)N)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CNC1=C(C=CC=N1)N)C(=O)O

InChI

InChI=1S/C13H20N4O4/c1-13(2,3)21-12(20)17-9(11(18)19)7-16-10-8(14)5-4-6-15-10/h4-6,9H,7,14H2,1-3H3,(H,15,16)(H,17,20)(H,18,19)