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

Details

Stereochemistry ABSOLUTE
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 ANHYDROUS

SMILES

Cl.FC1=CC=C(C=C1)[C@@H]2CCNC[C@H]2COC3=CC=C4OCOC4=C3

InChI

InChIKey=GELRVIPPMNMYGS-RVXRQPKJSA-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 ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

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

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:52:21 UTC 2023
Edited
by admin
on Fri Dec 15 15:52:21 UTC 2023
Record UNII
3I3T11UD2S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PAROXETINE HYDROCHLORIDE ANHYDROUS
Common Name English
Paroxetine hydrochloride [WHO-DD]
Common Name English
(-)-(3S,4R)-4-(P-FLUOROPHENYL)-3-((3,4-METHYLENEDIOXY)PHENOXY)-METHYL)PIPERIDINE HYDROCHLORIDE
Common Name English
NSC-758654
Code English
PAROXETINE HYDROCHLORIDE, ANHYDROUS
Common Name English
PAROXETINE HYDROCHLORIDE ANHYDROUS [MI]
Common Name English
PIPERIDINE, 3-((1,3-BENZODIOXOL-5-YLOXY)METHYL)-4-(4-FLUOROPHENYL)-, HYDROCHLORIDE, (3S-TRANS)-
Systematic Name English
Code System Code Type Description
NCI_THESAURUS
C1837
Created by admin on Fri Dec 15 15:52:21 UTC 2023 , Edited by admin on Fri Dec 15 15:52:21 UTC 2023
PRIMARY
CHEBI
7944
Created by admin on Fri Dec 15 15:52:21 UTC 2023 , Edited by admin on Fri Dec 15 15:52:21 UTC 2023
PRIMARY
EVMPD
SUB21705
Created by admin on Fri Dec 15 15:52:21 UTC 2023 , Edited by admin on Fri Dec 15 15:52:21 UTC 2023
PRIMARY
SMS_ID
100000089965
Created by admin on Fri Dec 15 15:52:21 UTC 2023 , Edited by admin on Fri Dec 15 15:52:21 UTC 2023
PRIMARY
HSDB
78246-49-8
Created by admin on Fri Dec 15 15:52:21 UTC 2023 , Edited by admin on Fri Dec 15 15:52:21 UTC 2023
PRIMARY
RXCUI
1311626
Created by admin on Fri Dec 15 15:52:21 UTC 2023 , Edited by admin on Fri Dec 15 15:52:21 UTC 2023
PRIMARY RxNorm
MERCK INDEX
m8418
Created by admin on Fri Dec 15 15:52:21 UTC 2023 , Edited by admin on Fri Dec 15 15:52:21 UTC 2023
PRIMARY
DAILYMED
3I3T11UD2S
Created by admin on Fri Dec 15 15:52:21 UTC 2023 , Edited by admin on Fri Dec 15 15:52:21 UTC 2023
PRIMARY
PUBCHEM
62878
Created by admin on Fri Dec 15 15:52:21 UTC 2023 , Edited by admin on Fri Dec 15 15:52:21 UTC 2023
PRIMARY
EPA CompTox
DTXSID50228914
Created by admin on Fri Dec 15 15:52:21 UTC 2023 , Edited by admin on Fri Dec 15 15:52:21 UTC 2023
PRIMARY
FDA UNII
3I3T11UD2S
Created by admin on Fri Dec 15 15:52:21 UTC 2023 , Edited by admin on Fri Dec 15 15:52:21 UTC 2023
PRIMARY
CAS
78246-49-8
Created by admin on Fri Dec 15 15:52:21 UTC 2023 , Edited by admin on Fri Dec 15 15:52:21 UTC 2023
PRIMARY
NSC
758654
Created by admin on Fri Dec 15 15:52:21 UTC 2023 , Edited by admin on Fri Dec 15 15:52:21 UTC 2023
PRIMARY
Related Record Type Details
SOLVATE->ANHYDROUS
SALT/SOLVATE -> PARENT
RACEMATE -> ENANTIOMER
Related Record Type Details
ACTIVE MOIETY