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Details

Stereochemistry RACEMIC
Molecular Formula C14H20ClN3O2
Molecular Weight 297.78
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of BIMOCLOMOL

SMILES

OC(CO\N=C(/Cl)C1=CN=CC=C1)CN2CCCCC2

InChI

InChIKey=NMOVJBAGBXIKCG-VKAVYKQESA-N
InChI=1S/C14H20ClN3O2/c15-14(12-5-4-6-16-9-12)17-20-11-13(19)10-18-7-2-1-3-8-18/h4-6,9,13,19H,1-3,7-8,10-11H2/b17-14-

HIDE SMILES / InChI

Molecular Formula C14H20ClN3O2
Molecular Weight 297.781
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 1
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 15:35:15 UTC 2023
Edited
by admin
on Fri Dec 15 15:35:15 UTC 2023
Record UNII
9IYF14814M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BIMOCLOMOL
INN   WHO-DD  
INN  
Official Name English
BRLP-42
Code English
(±)-N-(2-HYDROXY-3-PIPERIDINOPROPOXY)NICOTINIMIDOYL CHLORIDE
Systematic Name English
bimoclomol [INN]
Common Name English
ABT-822
Code English
Bimoclomol [WHO-DD]
Common Name English
Code System Code Type Description
ChEMBL
CHEMBL2104595
Created by admin on Fri Dec 15 15:35:15 UTC 2023 , Edited by admin on Fri Dec 15 15:35:15 UTC 2023
PRIMARY
CAS
130493-03-7
Created by admin on Fri Dec 15 15:35:15 UTC 2023 , Edited by admin on Fri Dec 15 15:35:15 UTC 2023
PRIMARY
EVMPD
SUB05833MIG
Created by admin on Fri Dec 15 15:35:15 UTC 2023 , Edited by admin on Fri Dec 15 15:35:15 UTC 2023
PRIMARY
PUBCHEM
9576891
Created by admin on Fri Dec 15 15:35:15 UTC 2023 , Edited by admin on Fri Dec 15 15:35:15 UTC 2023
PRIMARY
SMS_ID
100000085905
Created by admin on Fri Dec 15 15:35:15 UTC 2023 , Edited by admin on Fri Dec 15 15:35:15 UTC 2023
PRIMARY
DRUG BANK
DB06258
Created by admin on Fri Dec 15 15:35:15 UTC 2023 , Edited by admin on Fri Dec 15 15:35:15 UTC 2023
PRIMARY
NCI_THESAURUS
C171764
Created by admin on Fri Dec 15 15:35:15 UTC 2023 , Edited by admin on Fri Dec 15 15:35:15 UTC 2023
PRIMARY
FDA UNII
9IYF14814M
Created by admin on Fri Dec 15 15:35:15 UTC 2023 , Edited by admin on Fri Dec 15 15:35:15 UTC 2023
PRIMARY
INN
7488
Created by admin on Fri Dec 15 15:35:15 UTC 2023 , Edited by admin on Fri Dec 15 15:35:15 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> ACTIVATOR
ENANTIOMER -> RACEMATE
ENANTIOMER -> RACEMATE
Related Record Type Details
ACTIVE MOIETY