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Details

Stereochemistry RACEMIC
Molecular Formula C20H19FN2O2.C2H2O4
Molecular Weight 428.4103
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-OXOCITALOPRAM OXALATE

SMILES

OC(=O)C(O)=O.CN(C)CCCC1(OC(=O)C2=C1C=CC(=C2)C#N)C3=CC=C(F)C=C3

InChI

InChIKey=OOOSHXRAOKIVNG-UHFFFAOYSA-N
InChI=1S/C20H19FN2O2.C2H2O4/c1-23(2)11-3-10-20(15-5-7-16(21)8-6-15)18-9-4-14(13-22)12-17(18)19(24)25-20;3-1(4)2(5)6/h4-9,12H,3,10-11H2,1-2H3;(H,3,4)(H,5,6)

HIDE SMILES / InChI

Approval Year

Patents

Patents

Name Type Language
3-OXOCITALOPRAM OXALATE
Common Name English
CITALOPRAM RELATED COMPOUND C
Common Name English
3-(3-DIMETHYLAMINOPROPYL)-3-(4-FLUOROPHENYL)-6-CYANO-1(3H)-ISOBENZOFURANONE OXALATE
Systematic Name English
5-ISOBENZOFURANCARBONITRILE, 1-(3-(DIMETHYLAMINO)PROPYL)-1-(4-FLUOROPHENYL)-1,3-DIHYDRO-3-OXO-, ETHANEDIOATE (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
MJH9W62EFS
Created by admin on Sat Dec 16 18:32:32 GMT 2023 , Edited by admin on Sat Dec 16 18:32:32 GMT 2023
PRIMARY
PUBCHEM
129318459
Created by admin on Sat Dec 16 18:32:32 GMT 2023 , Edited by admin on Sat Dec 16 18:32:32 GMT 2023
PRIMARY
CAS
1440961-11-4
Created by admin on Sat Dec 16 18:32:32 GMT 2023 , Edited by admin on Sat Dec 16 18:32:32 GMT 2023
PRIMARY