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Details

Stereochemistry RACEMIC
Molecular Formula C14H23BrNO3.I
Molecular Weight 460.146
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FUBROGONIUM IODIDE

SMILES

[I-].CC[N+](C)(CC)CCC(C)OC(=O)C1=CC=C(Br)O1

InChI

InChIKey=KROWHJNUJMVHNU-UHFFFAOYSA-M
InChI=1S/C14H23BrNO3.HI/c1-5-16(4,6-2)10-9-11(3)18-14(17)12-7-8-13(15)19-12;/h7-8,11H,5-6,9-10H2,1-4H3;1H/q+1;/p-1

HIDE SMILES / InChI

Approval Year

Name Type Language
FUBROGONIUM IODIDE
INN  
INN  
Official Name English
fubrogonium iodide [INN]
Common Name English
DIETHYL (3-HYDROXYBUTYL)METHYLAMMONIUM IODIDE 5-BROMO-2-FUROATE
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C29696
Created by admin on Fri Dec 15 16:08:14 UTC 2023 , Edited by admin on Fri Dec 15 16:08:14 UTC 2023
NCI_THESAURUS C66886
Created by admin on Fri Dec 15 16:08:14 UTC 2023 , Edited by admin on Fri Dec 15 16:08:14 UTC 2023
Code System Code Type Description
EVMPD
SUB07824MIG
Created by admin on Fri Dec 15 16:08:14 UTC 2023 , Edited by admin on Fri Dec 15 16:08:14 UTC 2023
PRIMARY
INN
2433
Created by admin on Fri Dec 15 16:08:14 UTC 2023 , Edited by admin on Fri Dec 15 16:08:14 UTC 2023
PRIMARY
MESH
C007788
Created by admin on Fri Dec 15 16:08:14 UTC 2023 , Edited by admin on Fri Dec 15 16:08:14 UTC 2023
PRIMARY
PUBCHEM
71529
Created by admin on Fri Dec 15 16:08:14 UTC 2023 , Edited by admin on Fri Dec 15 16:08:14 UTC 2023
PRIMARY
ChEMBL
CHEMBL2110930
Created by admin on Fri Dec 15 16:08:14 UTC 2023 , Edited by admin on Fri Dec 15 16:08:14 UTC 2023
PRIMARY
CAS
3690-58-2
Created by admin on Fri Dec 15 16:08:14 UTC 2023 , Edited by admin on Fri Dec 15 16:08:14 UTC 2023
PRIMARY
EPA CompTox
DTXSID90958102
Created by admin on Fri Dec 15 16:08:14 UTC 2023 , Edited by admin on Fri Dec 15 16:08:14 UTC 2023
PRIMARY
FDA UNII
4791MN0PVE
Created by admin on Fri Dec 15 16:08:14 UTC 2023 , Edited by admin on Fri Dec 15 16:08:14 UTC 2023
PRIMARY
SMS_ID
100000080671
Created by admin on Fri Dec 15 16:08:14 UTC 2023 , Edited by admin on Fri Dec 15 16:08:14 UTC 2023
PRIMARY
NCI_THESAURUS
C65776
Created by admin on Fri Dec 15 16:08:14 UTC 2023 , Edited by admin on Fri Dec 15 16:08:14 UTC 2023
PRIMARY