- 2 of 2 defined stereocentres
(3S,3aR)-2-(3-Chloro-4-cyanophenyl)-3-cyclopentyl-3,3a,4,5-tetrahydro-2H-benzo[g]indazole-7-carboxylic acid
c1cc2c(cc1C(=O)O)CC[C@H]3C2=NN([C@H]3C4CCCC4)c5ccc(c(c5)Cl)C#N
InChI=1S/C24H22ClN3O2/c25-21-12-18(8-5-17(21)13-26)28-23(14-3-1-2-4-14)20-10-6-15-11-16(24(29)30)7-9-19(15)22(20)27-28/h5,7-9,11-12,14,20,23H,1-4,6,10H2,(H,29,30)/t20-,23-/m0/s1
XNULRSOGWPFPBL-REWPJTCUSA-N
CSID:25053860, http://www.chemspider.com/Chemical-Structure.25053860.html (accessed 12:05, Mar 29, 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
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