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Details

Stereochemistry ACHIRAL
Molecular Formula C15H22N4O
Molecular Weight 274.3614
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(HEXAHYDRO-4-METHYL-1H-1,4-DIAZEPIN-1-YL)-1H-BENZIMIDAZOLE-1-ETHANOL

SMILES

CN1CCCN(CC1)C2=NC3=C(C=CC=C3)N2CCO

InChI

InChIKey=CEKHHTUJXZICRR-UHFFFAOYSA-N
InChI=1S/C15H22N4O/c1-17-7-4-8-18(10-9-17)15-16-13-5-2-3-6-14(13)19(15)11-12-20/h2-3,5-6,20H,4,7-12H2,1H3

HIDE SMILES / InChI

Molecular Formula C15H22N4O
Molecular Weight 274.3614
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 Sat Dec 16 18:17:59 UTC 2023
Edited
by admin
on Sat Dec 16 18:17:59 UTC 2023
Record UNII
S6RGJ8D6BQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(HEXAHYDRO-4-METHYL-1H-1,4-DIAZEPIN-1-YL)-1H-BENZIMIDAZOLE-1-ETHANOL
Systematic Name English
1H-BENZIMIDAZOLE-1-ETHANOL, 2-(HEXAHYDRO-4-METHYL-1H-1,4-DIAZEPIN-1-YL)-
Systematic Name English
EMEDASTINE DIFUMARATE IMPURITY C [EP IMPURITY]
Common Name English
2-(2-(4-METHYLHEXAHYDRO-1H-1,4-DIAZEPIN-1-YL)-1H-BENZIMIDAZOL-1-YL)ETHANOL
Systematic Name English
Code System Code Type Description
FDA UNII
S6RGJ8D6BQ
Created by admin on Sat Dec 16 18:17:59 UTC 2023 , Edited by admin on Sat Dec 16 18:17:59 UTC 2023
PRIMARY
CAS
122423-32-9
Created by admin on Sat Dec 16 18:17:59 UTC 2023 , Edited by admin on Sat Dec 16 18:17:59 UTC 2023
PRIMARY
PUBCHEM
14356120
Created by admin on Sat Dec 16 18:17:59 UTC 2023 , Edited by admin on Sat Dec 16 18:17:59 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP