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

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-nitroimidazol-4-yl)propanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-3-(4-nitroimidazol-4-yl)propanoic acid CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(4-nitro-4-imidazolyl)propanoic acid IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(4-nitroimidazol-4-yl)propanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-3-(4-nitroimidazol-4-yl)propionic acid Formula: C11H16N4O6 MolecularWeight: 300.26794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1(C=NC=N1)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1(C=NC=N1)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C11H16N4O6/c1-10(2,3)21-9(18)14-7(8(16)17)4-11(15(19)20)5-12-6-13-11/h5-7H,4H2,1-3H3,(H,14,18)(H,16,17)