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Details

Stereochemistry ACHIRAL
Molecular Formula C16H23N3O4
Molecular Weight 321.3715
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIHYDROXY BENDAMUSTINE

SMILES

CN1C(CCCC(O)=O)=NC2=C1C=CC(=C2)N(CCO)CCO

InChI

InChIKey=XQMDIDKYVZPCNV-UHFFFAOYSA-N
InChI=1S/C16H23N3O4/c1-18-14-6-5-12(19(7-9-20)8-10-21)11-13(14)17-15(18)3-2-4-16(22)23/h5-6,11,20-21H,2-4,7-10H2,1H3,(H,22,23)

HIDE SMILES / InChI

Molecular Formula C16H23N3O4
Molecular Weight 321.3715
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 09:34:00 UTC 2023
Edited
by admin
on Sat Dec 16 09:34:00 UTC 2023
Record UNII
64ELC90802
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DIHYDROXY BENDAMUSTINE
Common Name English
1H-BENZIMIDAZOLE-2-BUTANOIC ACID, 5-(BIS(2-HYDROXYETHYL)AMINO)-1-METHYL-
Systematic Name English
DES(DI(2-CHLOROETHYL))-DI(2-HYDROXYETHYL) BENDAMUSTINE
Common Name English
BENDAMUSTINE RELATED COMPOUND A [USP IMPURITY]
Common Name English
4-(5-(BIS(2-HYDROXYETHYL)AMINO)-1-METHYL-1H-BENZIMIDAZOL-2-YL)BUTANOIC ACID
Common Name English
BENDAMUSTINE RELATED COMPOUND A
Common Name English
HP2
Common Name English
Code System Code Type Description
CAS
109882-30-6
Created by admin on Sat Dec 16 09:34:00 UTC 2023 , Edited by admin on Sat Dec 16 09:34:00 UTC 2023
PRIMARY
RS_ITEM_NUM
1065232
Created by admin on Sat Dec 16 09:34:00 UTC 2023 , Edited by admin on Sat Dec 16 09:34:00 UTC 2023
PRIMARY
FDA UNII
64ELC90802
Created by admin on Sat Dec 16 09:34:00 UTC 2023 , Edited by admin on Sat Dec 16 09:34:00 UTC 2023
PRIMARY
EPA CompTox
DTXSID00548492
Created by admin on Sat Dec 16 09:34:00 UTC 2023 , Edited by admin on Sat Dec 16 09:34:00 UTC 2023
PRIMARY
PUBCHEM
13755672
Created by admin on Sat Dec 16 09:34:00 UTC 2023 , Edited by admin on Sat Dec 16 09:34:00 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP
PARENT -> IMPURITY