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Details

Stereochemistry RACEMIC
Molecular Formula C14H21N3O
Molecular Weight 247.336
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-BENZOYL-2-(1-METHYLHEXAHYDRO-1H-AZEPIN-4-YL)DIAZANE

SMILES

CN1CCCC(CC1)NNC(=O)C2=CC=CC=C2

InChI

InChIKey=HJCSHXABAVJCGJ-UHFFFAOYSA-N
InChI=1S/C14H21N3O/c1-17-10-5-8-13(9-11-17)15-16-14(18)12-6-3-2-4-7-12/h2-4,6-7,13,15H,5,8-11H2,1H3,(H,16,18)

HIDE SMILES / InChI
Molecular Formula C14H21N3O
Molecular Weight 247.336
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Unknown
149124
Substance Class Chemical
Created
by admin
on Mon Mar 31 21:33:30 GMT 2025
Edited
by admin
on Mon Mar 31 21:33:30 GMT 2025
Record UNII
X4157Q0DP6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AZELASTINE HYDROCHLORIDE IMPURITY B [EP IMPURITY]
Preferred Name English
1-BENZOYL-2-(1-METHYLHEXAHYDRO-1H-AZEPIN-4-YL)DIAZANE
Systematic Name English
1-BENZOYL-2-(1-METHYLHEXAHYDRO-1H-AZEPIN-4-YL)DIAZANE, (±)-
Systematic Name English
1-BENZOYL-2-((4RS)-1-METHYLHEXAHYDRO-1H-AZEPIN-4-YL)DIAZANE
Systematic Name English
AZELASTINE RELATED COMPOUND B [USP-RS]
Common Name English
AZELASTINE RELATED COMPOUND B [USP IMPURITY]
Common Name English
BENZOIC ACID, 2-(HEXAHYDRO-1-METHYL-1H-AZEPIN-4-YL)HYDRAZIDE
Common Name English
(±)-1-BENZOYL-2-(1-METHYLHEXAHYDRO-1H-AZEPIN-4-YL)DIAZANE
Systematic Name English
Code System Code Type Description
PUBCHEM
14014367
Created by admin on Mon Mar 31 21:33:30 GMT 2025 , Edited by admin on Mon Mar 31 21:33:30 GMT 2025
PRIMARY
FDA UNII
X4157Q0DP6
Created by admin on Mon Mar 31 21:33:30 GMT 2025 , Edited by admin on Mon Mar 31 21:33:30 GMT 2025
PRIMARY
RS_ITEM_NUM
1046170
Created by admin on Mon Mar 31 21:33:30 GMT 2025 , Edited by admin on Mon Mar 31 21:33:30 GMT 2025
PRIMARY
CAS
110406-94-5
Created by admin on Mon Mar 31 21:33:30 GMT 2025 , Edited by admin on Mon Mar 31 21:33:30 GMT 2025
PRIMARY
Related Record Type Details
Structure of 1-Benzoyl-2-(1-methylhexahydro-1H-azepin-4-yl)diazane hydrochloride
SALT/SOLVATE -> PARENT
Related Record Type Details
Structure of AZELASTINE HYDROCHLORIDE
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
NIH
NCATS
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