2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[2-(trifluoromethyl)-1H-imidazol-5-yl]propanoic acid

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[2-(trifluoromethyl)-1H-imidazol-5-yl]propanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-3-[2-(trifluoromethyl)-1H-imidazol-5-yl]propanoic acid CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[2-(trifluoromethyl)-1H-imidazol-5-yl]propanoic acid IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[2-(trifluoromethyl)-1H-imidazol-5-yl]propanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-3-[2-(trifluoromethyl)-1H-imidazol-5-yl]propionic acid Formula: C12H16F3N3O4 MolecularWeight: 323.26835

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CN=C(N1)C(F)(F)F)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CN=C(N1)C(F)(F)F)C(=O)O

InChI

InChI=1S/C12H16F3N3O4/c1-11(2,3)22-10(21)18-7(8(19)20)4-6-5-16-9(17-6)12(13,14)15/h5,7H,4H2,1-3H3,(H,16,17)(H,18,21)(H,19,20)