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Details

Stereochemistry ACHIRAL
Molecular Formula C23H27Cl2N3O3
Molecular Weight 464.385
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ARIPIPRAZOLE N1-OXIDE

SMILES

[O-][N+]3(CCCCOC1=CC=C2CCC(=O)NC2=C1)CCN(CC3)C4=CC=CC(Cl)=C4Cl

InChI

InChIKey=ZNYNDJDSFMRJPS-UHFFFAOYSA-N
InChI=1S/C23H27Cl2N3O3/c24-19-4-3-5-21(23(19)25)27-10-13-28(30,14-11-27)12-1-2-15-31-18-8-6-17-7-9-22(29)26-20(17)16-18/h3-6,8,16H,1-2,7,9-15H2,(H,26,29)

HIDE SMILES / InChI

Molecular Formula C23H27Cl2N3O3
Molecular Weight 464.385
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 Thu Jul 06 20:13:08 UTC 2023
Edited
by admin
on Thu Jul 06 20:13:08 UTC 2023
Record UNII
5NO9KAA6QP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ARIPIPRAZOLE N1-OXIDE
Common Name English
ARIPIPRAZOLE RELATED COMPOUND F [USP-RS]
Common Name English
ARIPIPRAZOLE IMPURITY F [EP IMPURITY]
Common Name English
2(1H)-QUINOLINONE, 7-(4-(4-(2,3-DICHLOROPHENYL)-1-OXIDO-1-PIPERAZINYL)BUTOXY)-3,4-DIHYDRO-
Systematic Name English
ARIPIPRAZOLE RELATED COMPOUND F [USP IMPURITY]
Common Name English
7-(4-(4-(2,3-DICHLOROPHENYL)-1-OXIDO-1-PIPERAZINYL)BUTOXY)-3,4-DIHYDRO-2(1H)-QUINOLINONE
Systematic Name English
Code System Code Type Description
FDA UNII
5NO9KAA6QP
Created by admin on Thu Jul 06 20:13:08 UTC 2023 , Edited by admin on Thu Jul 06 20:13:08 UTC 2023
PRIMARY
EPA CompTox
DTXSID00437791
Created by admin on Thu Jul 06 20:13:08 UTC 2023 , Edited by admin on Thu Jul 06 20:13:08 UTC 2023
PRIMARY
PUBCHEM
10288582
Created by admin on Thu Jul 06 20:13:08 UTC 2023 , Edited by admin on Thu Jul 06 20:13:08 UTC 2023
PRIMARY
RS_ITEM_NUM
1042689
Created by admin on Thu Jul 06 20:13:08 UTC 2023 , Edited by admin on Thu Jul 06 20:13:08 UTC 2023
PRIMARY
CAS
573691-09-5
Created by admin on Thu Jul 06 20:13:08 UTC 2023 , Edited by admin on Thu Jul 06 20:13:08 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP