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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H17Cl2N.ClH
Molecular Weight 342.691
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SERTRALINE HYDROCHLORIDE, CIS-(-)-

SMILES

Cl.CN[C@@H]1CC[C@H](C2=CC(Cl)=C(Cl)C=C2)C3=C1C=CC=C3

InChI

InChIKey=BLFQGGGGFNSJKA-JSUROZADSA-N
InChI=1S/C17H17Cl2N.ClH/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;1H/t12-,17-;/m1./s1

HIDE SMILES / InChI

Molecular Formula C17H17Cl2N
Molecular Weight 306.23
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
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 07:58:28 UTC 2023
Edited
by admin
on Sat Dec 16 07:58:28 UTC 2023
Record UNII
H0905KBO3H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SERTRALINE HYDROCHLORIDE, CIS-(-)-
Common Name English
1-NAPHTHALENAMINE, 4-(3,4-DICHLOROPHENYL)-1,2,3,4-TETRAHYDRO-N-METHYL-, HYDROCHLORIDE (1:1), (1R,4R)-
Systematic Name English
SERTRALINE HYDROCHLORIDE, (1R,4R)-
Common Name English
(R,R)-SERTRALINE HYDROCHLORIDE
Common Name English
CP-51973 HYDROCHLORIDE
Code English
SERTRALINE HYDROCHLORIDE IMPURITY, (R,R) SERTRALINE HYDROCHLORIDE- [USP IMPURITY]
Common Name English
1-NAPHTHALENAMINE, 4-(3,4-DICHLOROPHENYL)-1,2,3,4-TETRAHYDRO-N-METHYL-, HYDROCHLORIDE, (1R-CIS)-
Systematic Name English
Code System Code Type Description
PUBCHEM
13408688
Created by admin on Sat Dec 16 07:58:28 UTC 2023 , Edited by admin on Sat Dec 16 07:58:28 UTC 2023
PRIMARY
CAS
79645-15-1
Created by admin on Sat Dec 16 07:58:28 UTC 2023 , Edited by admin on Sat Dec 16 07:58:28 UTC 2023
PRIMARY
FDA UNII
H0905KBO3H
Created by admin on Sat Dec 16 07:58:28 UTC 2023 , Edited by admin on Sat Dec 16 07:58:28 UTC 2023
PRIMARY