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Details

Stereochemistry ACHIRAL
Molecular Formula C11H15BrFN3O.ClH
Molecular Weight 340.62
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of FLUBROBENGUANE HYDROCHLORIDE

SMILES

Cl.NC(=N)NCC1=CC(Br)=C(OCCCF)C=C1

InChI

InChIKey=ZMDQPUBVHXGQKW-UHFFFAOYSA-N
InChI=1S/C11H15BrFN3O.ClH/c12-9-6-8(7-16-11(14)15)2-3-10(9)17-5-1-4-13;/h2-3,6H,1,4-5,7H2,(H4,14,15,16);1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C11H15BrFN3O
Molecular Weight 304.159
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 14:58:26 GMT 2023
Edited
by admin
on Sat Dec 16 14:58:26 GMT 2023
Record UNII
EZV5GD3B3N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FLUBROBENGUANE HYDROCHLORIDE
Common Name English
GUANIDINE, N-((3-BROMO-4-(3-FLUOROPROPOXY)PHENYL)METHYL)-, HYDROCHLORIDE (1:1)
Systematic Name English
Code System Code Type Description
PUBCHEM
68519465
Created by admin on Sat Dec 16 14:58:26 GMT 2023 , Edited by admin on Sat Dec 16 14:58:26 GMT 2023
PRIMARY
FDA UNII
EZV5GD3B3N
Created by admin on Sat Dec 16 14:58:26 GMT 2023 , Edited by admin on Sat Dec 16 14:58:26 GMT 2023
PRIMARY
CAS
1037078-70-8
Created by admin on Sat Dec 16 14:58:26 GMT 2023 , Edited by admin on Sat Dec 16 14:58:26 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE