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Details

Stereochemistry ACHIRAL
Molecular Formula C22H28ClN3O2
Molecular Weight 401.93
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-[3-(7-Chlorodibenz[b,e][1,4]oxazepin-5(11H)-yl)propyl]-1-piperazineethanol

SMILES

OCCN1CCN(CCCN2C3=C(COC4=C2C=C(Cl)C=C4)C=CC=C3)CC1

InChI

InChIKey=XQXPXVNTJBOLGO-UHFFFAOYSA-N
InChI=1S/C22H28ClN3O2/c23-19-6-7-22-21(16-19)26(20-5-2-1-4-18(20)17-28-22)9-3-8-24-10-12-25(13-11-24)14-15-27/h1-2,4-7,16,27H,3,8-15,17H2

HIDE SMILES / InChI

Molecular Formula C22H28ClN3O2
Molecular Weight 401.93
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 Tue Apr 01 16:21:59 GMT 2025
Edited
by admin
on Tue Apr 01 16:21:59 GMT 2025
Record UNII
25F52SBP8T
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-[3-(7-Chlorodibenz[b,e][1,4]oxazepin-5(11H)-yl)propyl]-1-piperazineethanol
Systematic Name English
1-Piperazineethanol, 4-[3-(7-chlorodibenz[b,e][1,4]oxazepin-5(11H)-yl)propyl]-
Preferred Name English
2-[4-[3-(2-Chloro-6h-benzo[c][1,5]benzoxazepin-11-yl)propyl]piperazin-1-yl]ethanol
Systematic Name English
SQ11,290
Code English
SQ-11,290
Code English
Code System Code Type Description
EPA CompTox
DTXSID40951007
Created by admin on Tue Apr 01 16:21:59 GMT 2025 , Edited by admin on Tue Apr 01 16:21:59 GMT 2025
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PUBCHEM
193095
Created by admin on Tue Apr 01 16:21:59 GMT 2025 , Edited by admin on Tue Apr 01 16:21:59 GMT 2025
PRIMARY
CAS
28318-18-5
Created by admin on Tue Apr 01 16:21:59 GMT 2025 , Edited by admin on Tue Apr 01 16:21:59 GMT 2025
PRIMARY
FDA UNII
25F52SBP8T
Created by admin on Tue Apr 01 16:21:59 GMT 2025 , Edited by admin on Tue Apr 01 16:21:59 GMT 2025
PRIMARY