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Details

Stereochemistry RACEMIC
Molecular Formula C15H20Cl2N2O
Molecular Weight 315.238
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of U-48800 N-DIDEMETHYL METABOLITE

SMILES

CN([C@H]1CCCC[C@@H]1N)C(=O)CC2=C(Cl)C=C(Cl)C=C2

InChI

InChIKey=GBQRFKKKAALQDC-KBPBESRZSA-N
InChI=1S/C15H20Cl2N2O/c1-19(14-5-3-2-4-13(14)18)15(20)8-10-6-7-11(16)9-12(10)17/h6-7,9,13-14H,2-5,8,18H2,1H3/t13-,14-/m0/s1

HIDE SMILES / InChI

Molecular Formula C15H20Cl2N2O
Molecular Weight 315.238
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 23:45:15 UTC 2023
Edited
by admin
on Thu Jul 06 23:45:15 UTC 2023
Record UNII
AGD7WG2HRW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
U-48800 N-DIDEMETHYL METABOLITE
Common Name English
N-DIDEMETHYL-U-48800
Code English
N-((1R,2R)-2-AMINOCYCLOHEXYL)-2-(2,4-DICHLOROPHENYL)-N-METHYL-ACETAMIDE, REL-
Systematic Name English
Code System Code Type Description
PUBCHEM
162368542
Created by admin on Thu Jul 06 23:45:15 UTC 2023 , Edited by admin on Thu Jul 06 23:45:15 UTC 2023
PRIMARY
FDA UNII
AGD7WG2HRW
Created by admin on Thu Jul 06 23:45:15 UTC 2023 , Edited by admin on Thu Jul 06 23:45:15 UTC 2023
PRIMARY
Related Record Type Details
METABOLITE -> PARENT