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Details

Stereochemistry RACEMIC
Molecular Formula C18H19NOS
Molecular Weight 297.415
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PARA-NAPHTHOL DULOXETINE

SMILES

CNCCC(C1=CC=CS1)C2=C3C=CC=CC3=C(O)C=C2

InChI

InChIKey=OJXMJLCWKLPCHB-UHFFFAOYSA-N
InChI=1S/C18H19NOS/c1-19-11-10-16(18-7-4-12-21-18)14-8-9-17(20)15-6-3-2-5-13(14)15/h2-9,12,16,19-20H,10-11H2,1H3

HIDE SMILES / InChI

Molecular Formula C18H19NOS
Molecular Weight 297.415
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 02:48:10 UTC 2023
Edited
by admin
on Sat Dec 16 02:48:10 UTC 2023
Record UNII
OX55AL7074
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PARA-NAPHTHOL DULOXETINE
Common Name English
DULOXETINE IMPURITY C
USP  
Common Name English
(±)-PARA-NAPHTHOL DULOXETINE
Common Name English
DULOXETINE HYDROCHLORIDE IMPURITY C [EP IMPURITY]
Common Name English
1-NAPHTHALENOL, 4-(3-(METHYLAMINO)-1-(2-THIENYL)PROPYL)-
Systematic Name English
DULOXETINE IMPURITY C [USP IMPURITY]
Common Name English
4-[(1RS)-3-(methylamino)-1-(thiophen-2-yl)propyl]naphthalen-1-ol
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID801211008
Created by admin on Sat Dec 16 02:48:10 UTC 2023 , Edited by admin on Sat Dec 16 02:48:10 UTC 2023
PRIMARY
PUBCHEM
23641781
Created by admin on Sat Dec 16 02:48:10 UTC 2023 , Edited by admin on Sat Dec 16 02:48:10 UTC 2023
PRIMARY
FDA UNII
OX55AL7074
Created by admin on Sat Dec 16 02:48:10 UTC 2023 , Edited by admin on Sat Dec 16 02:48:10 UTC 2023
PRIMARY
CAS
949095-98-1
Created by admin on Sat Dec 16 02:48:10 UTC 2023 , Edited by admin on Sat Dec 16 02:48:10 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY