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Details

Stereochemistry ABSOLUTE
Molecular Formula C35H38F6N4O2
Molecular Weight 660.6922
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of R-116031

SMILES

CC1=CC=CC(C)=C1NC(=O)CN2CCN(CC2)[C@H]3CCN([C@H](CC4=CC=CC=C4)C3)C(=O)C5=CC(=CC(=C5)C(F)(F)F)C(F)(F)F

InChI

InChIKey=KHOXGPDKCIQOOR-XZWHSSHBSA-N
InChI=1S/C35H38F6N4O2/c1-23-7-6-8-24(2)32(23)42-31(46)22-43-13-15-44(16-14-43)29-11-12-45(30(21-29)17-25-9-4-3-5-10-25)33(47)26-18-27(34(36,37)38)20-28(19-26)35(39,40)41/h3-10,18-20,29-30H,11-17,21-22H2,1-2H3,(H,42,46)/t29-,30+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
R116031
Preferred Name English
R-116031
Common Name English
1-Piperazineacetamide, 4-[(2R,4S)-1-[3,5-bis(trifluoromethyl)benzoyl]-2-(phenylmethyl)-4-piperidinyl]-N-(2,6-dimethylphenyl)-
Systematic Name English
Code System Code Type Description
PUBCHEM
9917716
Created by admin on Wed Apr 02 21:23:38 GMT 2025 , Edited by admin on Wed Apr 02 21:23:38 GMT 2025
PRIMARY
FDA UNII
5GT89LA9ED
Created by admin on Wed Apr 02 21:23:38 GMT 2025 , Edited by admin on Wed Apr 02 21:23:38 GMT 2025
PRIMARY
CAS
336884-84-5
Created by admin on Wed Apr 02 21:23:38 GMT 2025 , Edited by admin on Wed Apr 02 21:23:38 GMT 2025
PRIMARY