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Details

Stereochemistry ABSOLUTE
Molecular Formula C16H24ClN
Molecular Weight 265.821
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DESMETHYLSIBUTRAMINE, (S)-

SMILES

CN[C@@H](CC(C)C)C1(CCC1)C2=CC=C(Cl)C=C2

InChI

InChIKey=PLXKZKLXYHLWHR-HNNXBMFYSA-N
InChI=1S/C16H24ClN/c1-12(2)11-15(18-3)16(9-4-10-16)13-5-7-14(17)8-6-13/h5-8,12,15,18H,4,9-11H2,1-3H3/t15-/m0/s1

HIDE SMILES / InChI

Molecular Formula C16H24ClN
Molecular Weight 265.821
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 Thu Jul 06 17:27:58 UTC 2023
Edited
by admin
on Thu Jul 06 17:27:58 UTC 2023
Record UNII
8QEZ44AFAI
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DESMETHYLSIBUTRAMINE, (S)-
Common Name English
(.ALPHA.S)-1-(4-CHLOROPHENYL)-N-METHYL-.ALPHA.-(2-METHYLPROPYL)CYCLOBUTANEMETHANAMINE
Common Name English
S-(-)-MONO-DESMETHYLSIBUTRAMINE
Common Name English
CYCLOBUTANEMETHANAMINE, 1-(4-CHLOROPHENYL)-N-METHYL-.ALPHA.-(2-METHYLPROPYL)-, (.ALPHA.S)-
Systematic Name English
Code System Code Type Description
CAS
229639-55-8
Created by admin on Thu Jul 06 17:27:58 UTC 2023 , Edited by admin on Thu Jul 06 17:27:58 UTC 2023
PRIMARY
FDA UNII
8QEZ44AFAI
Created by admin on Thu Jul 06 17:27:58 UTC 2023 , Edited by admin on Thu Jul 06 17:27:58 UTC 2023
PRIMARY
PUBCHEM
9838199
Created by admin on Thu Jul 06 17:27:58 UTC 2023 , Edited by admin on Thu Jul 06 17:27:58 UTC 2023
PRIMARY
Related Record Type Details
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