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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H16ClNO
Molecular Weight 237.725
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(3-Chlorophenyl)-2-(methylamino)cyclohexanone, (2S)-

SMILES

CN[C@@]1(CCCCC1=O)C2=CC(Cl)=CC=C2

InChI

InChIKey=NDVCZDFFOQKAGV-ZDUSSCGKSA-N
InChI=1S/C13H16ClNO/c1-15-13(8-3-2-7-12(13)16)10-5-4-6-11(14)9-10/h4-6,9,15H,2-3,7-8H2,1H3/t13-/m0/s1

HIDE SMILES / InChI

Molecular Formula C13H16ClNO
Molecular Weight 237.725
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 20:56:18 GMT 2025
Edited
by admin
on Wed Apr 02 20:56:18 GMT 2025
Record UNII
WMU28VTS57
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(3-Chlorophenyl)-2-(methylamino)cyclohexanone, (2S)-
Systematic Name English
(2S)-2-(3-Chlorophenyl)-2-(methylamino)cyclohexanone
Preferred Name English
Cyclohexanone, 2-(3-chlorophenyl)-2-(methylamino)-, (2S)-
Systematic Name English
Code System Code Type Description
CAS
946131-87-9
Created by admin on Wed Apr 02 20:56:18 GMT 2025 , Edited by admin on Wed Apr 02 20:56:18 GMT 2025
PRIMARY
PUBCHEM
14390094
Created by admin on Wed Apr 02 20:56:18 GMT 2025 , Edited by admin on Wed Apr 02 20:56:18 GMT 2025
PRIMARY
FDA UNII
WMU28VTS57
Created by admin on Wed Apr 02 20:56:18 GMT 2025 , Edited by admin on Wed Apr 02 20:56:18 GMT 2025
PRIMARY
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