U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS
This repository is under review for potential modification in compliance with Administration directives.

Details

Stereochemistry RACEMIC
Molecular Formula C16H24ClN
Molecular Weight 265.821
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DESMETHYLSIBUTRAMINE

SMILES

CNC(CC(C)C)C1(CCC1)C2=CC=C(Cl)C=C2

InChI

InChIKey=PLXKZKLXYHLWHR-UHFFFAOYSA-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

HIDE SMILES / InChI

Molecular Formula C16H24ClN
Molecular Weight 265.821
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Record UNII
889I657R9P
Record Status Validated (UNII)
Record Version