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Details

Stereochemistry RACEMIC
Molecular Formula C16H22Cl2N2O
Molecular Weight 329.265
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

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

SMILES

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

InChI

InChIKey=XMGQXJDAJLFVTD-GJZGRUSLSA-N
InChI=1S/C16H22Cl2N2O/c1-19-14-5-3-4-6-15(14)20(2)16(21)9-11-7-8-12(17)10-13(11)18/h7-8,10,14-15,19H,3-6,9H2,1-2H3/t14-,15-/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H22Cl2N2O
Molecular Weight 329.265
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 23:39:48 UTC 2023
Edited
by admin
on Thu Jul 06 23:39:48 UTC 2023
Record UNII
GUK4SDZ9MX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
U-48800 N-DEMETHYL METABOLITE
Common Name English
N-DEMETHYL-U-48800
Code English
2-(2,4-DICHLOROPHENYL)-N-METHYL-N-((1R,2R)-2-(METHYLAMINO)CYCLOHEXYL)ACETAMIDE, REL-
Systematic Name English
Code System Code Type Description
PUBCHEM
162368522
Created by admin on Thu Jul 06 23:39:48 UTC 2023 , Edited by admin on Thu Jul 06 23:39:48 UTC 2023
PRIMARY
FDA UNII
GUK4SDZ9MX
Created by admin on Thu Jul 06 23:39:48 UTC 2023 , Edited by admin on Thu Jul 06 23:39:48 UTC 2023
PRIMARY
Related Record Type Details
METABOLITE -> PARENT