Catalog Number | 43303 |
---|---|
CAS | 2177-63-1 |
M.W. | 223.23 |
Formula | C11H13NO4 |
IUPAC Name | (1S,2R)-2-[2-[[3-(1H-benzimidazol-2-yl)-1,1,2,2,3,3-hexadeuteriopropyl]-(trideuteriomethyl)amino]ethyl]-4,4,6-trifluoro-1-propan-2-yl-1,3-dihydronaphthalen-2-ol |
Synonym | L-Aspartic acid beta-benzyl ester |
InChIKey | KCQBOYKJQNUPEI-SNWPULQPSA-N |
InChI | InChI=1S/C26H32F3N3O/c1-17(2)24-19-11-10-18(27)15-20(19)26(28,29)16-25(24,33)12-14-32(3)13-6-9-23-30-21-7-4-5-8-22(21)31-23/h4-5,7-8,10-11,15,17,24,33H,6,9,12-14,16H2,1-3H3,(H,30,31)/t24-,25+/m0/s1/i3D3,6D2,9D2,13D2 |
SMILES | [2H]C([2H])([2H])N(CC[C@]1(CC(C2=C([C@@H]1C(C)C)C=CC(=C2)F)(F)F)O)C([2H])([2H])C([2H])([2H])C([2H])([2H])C3=NC4=CC=CC=C4N3 |