Catalog Number:
AG000O85
Chemical Name:
2-Azabicyclo[2.2.1]heptane-2-carboxylic acid, 3-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-benzimidazol-2-yl]-, 1,1-dimethylethyl ester, (1R,3S,4S)-
CAS Number:
1256387-87-7
Molecular Formula:
C24H34BN3O4
Molecular Weight:
439.3555
MDL Number:
MFCD28386938
IUPAC Name:
tert-butyl (1R,3S,4S)-3-[6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-benzimidazol-2-yl]-2-azabicyclo[2.2.1]heptane-2-carboxylate
InChI:
InChI=1S/C24H34BN3O4/c1-22(2,3)30-21(29)28-16-10-8-14(12-16)19(28)20-26-17-11-9-15(13-18(17)27-20)25-31-23(4,5)24(6,7)32-25/h9,11,13-14,16,19H,8,10,12H2,1-7H3,(H,26,27)/t14-,16+,19-/m0/s1
InChI Key:
MYPUONINDNZBTH-GMBSWORKSA-N
SMILES:
O=C(N1[C@@H]2CC[C@H]([C@H]1c1nc3c([nH]1)cc(cc3)B1OC(C(O1)(C)C)(C)C)C2)OC(C)(C)C
