U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C17H21NO.ClH
Molecular Weight 291.816
Optical Activity ( + )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ATOMOXETINE HYDROCHLORIDE, (S)-

SMILES

Cl.CNCC[C@H](OC1=CC=CC=C1C)C2=CC=CC=C2

InChI

InChIKey=LUCXVPAZUDVVBT-LMOVPXPDSA-N
InChI=1S/C17H21NO.ClH/c1-14-8-6-7-11-16(14)19-17(12-13-18-2)15-9-4-3-5-10-15;/h3-11,17-18H,12-13H2,1-2H3;1H/t17-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C17H21NO
Molecular Weight 255.3547
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:31:48 GMT 2023
Edited
by admin
on Sat Dec 16 19:31:48 GMT 2023
Record UNII
EHM88LDX7Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ATOMOXETINE HYDROCHLORIDE, (S)-
Common Name English
LY-139602
Code English
(S)-(+)-Tomoxetine hydrochloride
Common Name English
Benzenepropanamine, N-methyl-γ-(2-methylphenoxy)-, hydrochloride (1:1), (γS)-
Common Name English
ATOMOXETINE S-ISOMER HYDROCHLORIDE [USP-RS]
Common Name English
Benzenepropanamine, N-methyl-γ-(2-methylphenoxy)-, hydrochloride, (S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
9926055
Created by admin on Sat Dec 16 19:31:48 GMT 2023 , Edited by admin on Sat Dec 16 19:31:48 GMT 2023
PRIMARY
FDA UNII
EHM88LDX7Z
Created by admin on Sat Dec 16 19:31:48 GMT 2023 , Edited by admin on Sat Dec 16 19:31:48 GMT 2023
PRIMARY
CAS
82857-39-4
Created by admin on Sat Dec 16 19:31:48 GMT 2023 , Edited by admin on Sat Dec 16 19:31:48 GMT 2023
PRIMARY
RS_ITEM_NUM
1044913
Created by admin on Sat Dec 16 19:31:48 GMT 2023 , Edited by admin on Sat Dec 16 19:31:48 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE