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Details

Stereochemistry UNKNOWN
Molecular Formula C19H20FNO3.ClH
Molecular Weight 365.826
Optical Activity ( - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

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

SMILES

Cl.FC1=CC=C(C=C1)[C@H]2CCNC[C@H]2COC3=CC4=C(OCO4)C=C3

InChI

InChIKey=GELRVIPPMNMYGS-SQQLFYIASA-N
InChI=1S/C19H20FNO3.ClH/c20-15-3-1-13(2-4-15)17-7-8-21-10-14(17)11-22-16-5-6-18-19(9-16)24-12-23-18;/h1-6,9,14,17,21H,7-8,10-12H2;1H/t14-,17+;/m0./s1

HIDE SMILES / InChI

Molecular Formula C19H20FNO3
Molecular Weight 329.3654
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 10:27:45 UTC 2023
Edited
by admin
on Sat Dec 16 10:27:45 UTC 2023
Record UNII
WR7U5L8J6B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PAROXETINE HYDROCHLORIDE, CIS-(-)-
Common Name English
PIPERIDINE, 3-((1,3-BENZODIOXOL-5-YLOXY)METHYL)-4-(4-FLUOROPHENYL)-, HYDROCHLORIDE, CIS-(-)-
Systematic Name English
REL-(-)-(3R,4R)-3-((BENZO(D)(1,3)DIOXOL-5-YLOXY)METHYL)-4-(4-FLUOROPHENYL)PIPERIDINE HYDROCHLORIDE
Systematic Name English
(-)-CIS-3-((1,3-BENZODIOXOL-5YLOXY)METHYL)-4-(4-FLUOROPHENYL)PIPERIDINE HYDROCHLORIDE
Systematic Name English
PAROXETINE HYDROCHLORIDE ANHYDROUS, CIS-
Common Name English
Code System Code Type Description
CAS
105813-04-5
Created by admin on Sat Dec 16 10:27:45 UTC 2023 , Edited by admin on Sat Dec 16 10:27:45 UTC 2023
PRIMARY
PUBCHEM
18635511
Created by admin on Sat Dec 16 10:27:45 UTC 2023 , Edited by admin on Sat Dec 16 10:27:45 UTC 2023
PRIMARY
EPA CompTox
DTXSID10595336
Created by admin on Sat Dec 16 10:27:45 UTC 2023 , Edited by admin on Sat Dec 16 10:27:45 UTC 2023
PRIMARY
RS_ITEM_NUM
1500251
Created by admin on Sat Dec 16 10:27:45 UTC 2023 , Edited by admin on Sat Dec 16 10:27:45 UTC 2023
PRIMARY
FDA UNII
WR7U5L8J6B
Created by admin on Sat Dec 16 10:27:45 UTC 2023 , Edited by admin on Sat Dec 16 10:27:45 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE