- 2 of 2 defined stereocentres
- Non-standard isotope
4-Amino-5-chloro-N-{(3S,4R)-1-[3-(4-fluorophenoxy)propyl]-3-methoxy-4-piperidinyl}-2-[(~13~C,~2~H_3_)methyloxy]benzamide
[13C]([2H])([2H])([2H])OC1=CC(=C(C=C1C(=N[C@@H]2CCN(CCCOC3=CC=C(C=C3)F)C[C@@H]2OC)O)Cl)N [2H][13C]([2H])([2H])Oc1cc(c(cc1C(=O)N[C@@H]2CCN(C[C@@H]2OC)CCCOc3ccc(cc3)F)Cl)N
InChI=1S/C23H29ClFN3O4/c1-30-21-13-19(26)18(24)12-17(21)23(29)27-20-8-10-28(14-22(20)31-2)9-3-11-32-16-6-4-15(25)5-7-16/h4-7,12-13,20,22H,3,8-11,14,26H2,1-2H3,(H,27,29)/t20-,22+/m1/s1/i1+1D3
DCSUBABJRXZOMT-WNJPBQIDSA-N
CSID:58781796, http://www.chemspider.com/Chemical-Structure.58781796.html (accessed 22:48, Apr 19, 2024)
Validated by Experts, Validated by Users, Non-Validated, Removed by Users
Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00
Click to predict properties on the Chemicalize site
Advertisement
Spotlight