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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H17Cl2N
Molecular Weight 306.23
Optical Activity ( + )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Sertraline, (1S,4R)-

SMILES

CN[C@H]1CC[C@H](C2=CC=C(Cl)C(Cl)=C2)C3=CC=CC=C13

InChI

InChIKey=VGKDLMBJGBXTGI-PXAZEXFGSA-N
InChI=1S/C17H17Cl2N/c1-20-17-9-7-12(13-4-2-3-5-14(13)17)11-6-8-15(18)16(19)10-11/h2-6,8,10,12,17,20H,7,9H2,1H3/t12-,17+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
Sertraline, (1S,4R)-
Common Name English
CP-52002
Preferred Name English
1-Naphthalenamine, 4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydro-N-methyl-, (1S-trans)-
Systematic Name English
(1S,4R)-4-(3,4-Dichlorophenyl)-1,2,3,4-tetrahydro-N-methyl-1-naphthalenamine
Systematic Name English
(1S,4R)-Sertraline
Common Name English
1-Naphthalenamine, 4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydro-N-methyl-, (1S,4R)
Systematic Name English
CP52002
Code English
Code System Code Type Description
CAS
91797-60-3
Created by admin on Wed Apr 02 19:05:42 GMT 2025 , Edited by admin on Wed Apr 02 19:05:42 GMT 2025
PRIMARY
PUBCHEM
6093397
Created by admin on Wed Apr 02 19:05:42 GMT 2025 , Edited by admin on Wed Apr 02 19:05:42 GMT 2025
PRIMARY
FDA UNII
5F33YNB65X
Created by admin on Wed Apr 02 19:05:42 GMT 2025 , Edited by admin on Wed Apr 02 19:05:42 GMT 2025
PRIMARY